Product Name :
CXCR7 modulator 1
Description:
CXCR7 modulator 1 (compound 25) is a potent and orally bioavailable peptoid hybrid CXCR7 modulator, with a Ki of 9 nM.
CAS:
2231812-31-8
Molecular Weight:
914.07
Formula:
C48H57F2N7O7S
Chemical Name:
(6S,9R,12S,15S,20aR)-9-benzyl-6-[(benzyloxy)methyl]-2-[3-(2,4-difluorophenyl)propyl]-12-(2,2-dimethylpropyl)-15-[(1,3-thiazol-4-yl)methyl]-icosahydropyrrolo[1,2-a]1,4,7,10,13,16-hexaazacyclooctadecane-1,4,7,10,13,16-hexone
Smiles :
CC(C)(C)C[C@@H]1NC(=O)[C@@H](CC2C=CC=CC=2)NC(=O)[C@H](COCC2C=CC=CC=2)NC(=O)CN(CCCC2C=CC(F)=CC=2F)C(=O)[C@H]2CCCN2C(=O)[C@H](CC2=CSC=N2)NC1=O
InChiKey:
ONBLFYRZNQPUFU-UNWHFORBSA-N
InChi :
InChI=1S/C48H57F2N7O7S/c1-48(2,3)25-39-44(60)54-38(24-35-29-65-30-51-35)46(62)57-21-11-17-41(57)47(63)56(20-10-16-33-18-19-34(49)23-36(33)50)26-42(58)52-40(28-64-27-32-14-8-5-9-15-32)45(61)53-37(43(59)55-39)22-31-12-6-4-7-13-31/h4-9,12-15,18-19,23,29-30,37-41H,10-11,16-17,20-22,24-28H2,1-3H3,(H,52,58)(H,53,61)(H,54,60)(H,55,59)/t37-,38+,39+,40+,41-/m1/s1
Purity:
≥98% (or refer to the Certificate of Analysis)
Shipping Condition:
Shipped under ambient temperature as non-hazardous chemical or refer to Certificate of Analysis
Storage Condition :
Dry, dark and -20 oC for 1 year or refer to the Certificate of Analysis.
Shelf Life:
≥12 months if stored properly.
Stock Solution Storage:
0 – 4 oC for 1 month or refer to the Certificate of Analysis.
Additional information:
CXCR7 modulator 1 (compound 25) is a potent and orally bioavailable peptoid hybrid CXCR7 modulator, with a Ki of 9 nM.|Product information|CAS Number: 2231812-31-8|Molecular Weight: 914.07|Formula: C48H57F2N7O7S|Chemical Name: (6S,9R,12S,15S,20aR)-9-benzyl-6-[(benzyloxy)methyl]-2-[3-(2,4-difluorophenyl)propyl]-12-(2,2-dimethylpropyl)-15-[(1,3-thiazol-4-yl)methyl]-icosahydropyrrolo[1,2-a]1,4,7,10,13,16-hexaazacyclooctadecane-1,4,7,10,13,16-hexone|Smiles: CC(C)(C)C[C@@H]1NC(=O)[C@@H](CC2C=CC=CC=2)NC(=O)[C@H](COCC2C=CC=CC=2)NC(=O)CN(CCCC2C=CC(F)=CC=2F)C(=O)[C@H]2CCCN2C(=O)[C@H](CC2=CSC=N2)NC1=O|InChiKey: ONBLFYRZNQPUFU-UNWHFORBSA-N|InChi: InChI=1S/C48H57F2N7O7S/c1-48(2,3)25-39-44(60)54-38(24-35-29-65-30-51-35)46(62)57-21-11-17-41(57)47(63)56(20-10-16-33-18-19-34(49)23-36(33)50)26-42(58)52-40(28-64-27-32-14-8-5-9-15-32)45(61)53-37(43(59)55-39)22-31-12-6-4-7-13-31/h4-9,12-15,18-19,23,29-30,37-41H,10-11,16-17,20-22,24-28H2,1-3H3,(H,52,58)(H,53,61)(H,54,60)(H,55,59)/t37-,38+,39+,40+,41-/m1/s1|Technical Data|Appearance: Solid Power|Purity: ≥98% (or refer to the Certificate of Analysis)|Solubility: DMSO : 250 mg/mL (273.{{ATP} site|{ATP} Metabolic Enzyme/Protease|{ATP} Protocol|{ATP} Purity|{ATP} custom synthesis|{ATP} Epigenetics} 50 mM; Need ultrasonic).{{Scoparone} site|{Scoparone} Technical Information|{Scoparone} Description|{Scoparone} custom synthesis|{Scoparone} Autophagy} |Shipping Condition: Shipped under ambient temperature as non-hazardous chemical or refer to Certificate of Analysis|Storage Condition: Dry, dark and -20 oC for 1 year or refer to the Certificate of Analysis.PMID:24406011 |Shelf Life: ≥12 months if stored properly.|Stock Solution Storage: 0 – 4 oC for 1 month or refer to the Certificate of Analysis.|Drug Formulation: To be determined|HS Tariff Code: 382200|Products are for research use only. Not for human use.|