2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol
TL;DR: 2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol (CAS 129467-50-1) is a chemical compound with molecular formula C44H54N4O8 and molecular weight 766.39417 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzyl N-[(2S)-1-[[(2S,3R,4S,5S)-3,4-dihydroxy-5-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-1,6-diphenylhexan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamate
Also Known As: BzOCValPhe(diCHOH(RS))PheValBzOC, BzOCValPhe[diCHOH(RS)]PheValBzOC, 2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol, L-Altritol, 1,2,5,6-tetradeoxy-2,5-bis((3-methyl-1-oxo-2-(((phenylmethoxy)carbonyl)amino)butyl)amino)-1,6-diphenyl-, (2(S),5(S))-, {(S)-1-[(1S,2S,3R,4S)-1-Benzyl-4-((S)-2-benzyloxycarbonylamino-3-methyl-butyrylamino)-2,3-dihydroxy-5-phenyl-pentylcarbamoyl]-2-methyl-propyl}-carbamic acid benzyl ester
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C44H54N4O8 |
| Molecular Weight | 766.39417 g/mol |
| XLogP | 6.9 |
| Topological Polar Surface Area (TPSA) | 175.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 21 |
| Exact Mass | 766.39417 Da |
| Heavy Atoms | 56 |
| Complexity | 1090.0 |
| SMILES | CC(C)[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)[C@H]([C@H]([C@H](CC2=CC=CC=C2)NC(=O)[C@H](C(C)C)NC(=O)OCC3=CC=CC=C3)O)O)NC(=O)OCC4=CC=CC=C4 |
| InChIKey | TZRRVSCDIPHXHN-BYAJYZPISA-N |
Chemical Property Profile of 2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol
Property Insights of 2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol
The XLogP value of 6.9 indicates that 2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 175.0 Ų indicates high polarity, suggesting 2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol?
The CAS number of 2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol is 129467-50-1.
What is the molecular formula of 2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol?
The molecular formula of 2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol is C44H54N4O8.
What is the molecular weight of 2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol?
The molecular weight of 2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol is 766.39417 g/mol.
Where can I buy 2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol?
You can request a quote for 2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol?
Yes, CoreyChem provides custom synthesis services for 2,5-Diamino-N,N'-bis(N-benzyloxycarbonylvalyl)-1,6-diphenyl-3(R),4(S)-hexanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.