1hvj
TL;DR: 1hvj (CAS 144141-70-8) is a chemical compound with molecular formula C44H58N8O5 and molecular weight 778.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-N-[(2S,4S,5S)-4-hydroxy-5-[[(2S)-3-methyl-2-[[methyl(pyridin-2-ylmethyl)carbamoyl]amino]butanoyl]amino]-1,6-diphenylhexan-2-yl]-3-methyl-2-[[methyl(pyridin-2-ylmethyl)carbamoyl]amino]butanamide
Also Known As: 1hvj, A-78791, 2,5,10,13-Tetraazatetradecanediamide, 7-hydroxy-N,N'-dimethyl-3,12-bis(1-methylethyl)-4,11-dioxo-6,9-bis(phenylmethyl)-N,N'-bis(2-pyridinylmethyl)-, (3S,6S,7S,9S,12S)-, 2,5-Diamino-2N,5N-bis(N-methyl-2-pyridylmethylaminocarbonylvalyl)-1,6-diphenyl-, 2,5,10,13-Tetraazatetradecanediamide, 7-hydroxy-N,N'-dimethyl-3,12-bis(1-methylethyl)-4,11-dioxo-6,9-bis(phenylmethyl)-N,N'-bis(2-pyridinylmethyl)-, (3S-(3R*,6R*,7R*,9R*,12R*))-
| Molecular Formula | C44H58N8O5 |
|---|---|
| Molecular Weight | 778.45 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 169.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 19 |
| Exact Mass | 778.453 |
| Heavy Atoms | 57 |
| Complexity | 1220.0 |
Chemical Identifiers
| CAS Number | 144141-70-8 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C[C@@H]([C@H](CC2=CC=CC=C2)NC(=O)[C@H](C(C)C)NC(=O)N(C)CC3=CC=CC=N3)O)NC(=O)N(C)CC4=CC=CC=N4 |
| InChIKey | KTXGTJRUYOGULA-HECCNADXSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1hvj (CAS 144141-70-8), with molecular formula C44H58N8O5 and molecular weight 778.45 g/mol. IUPAC: (2S)-N-[(2S,4S,5S)-4-hydroxy-5-[[(2S)-3-methyl-2-[[methyl(pyridin-2-ylmethyl)carbamoyl]amino]butanoyl]amino]-1,6-diphenylhexan-2-yl]-3-methyl-2-[[methyl(pyridin-2-ylmethyl)carbamoyl]amino]butanamide.
Chemical Property Profile of 1hvj
Property Insights of 1hvj
The XLogP value of 5.0 indicates that 1hvj is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 169.0 Ų indicates high polarity, suggesting 1hvj may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1hvj has 5 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1hvj?
The CAS number of 1hvj is 144141-70-8.
What is the molecular formula of 1hvj?
The molecular formula of 1hvj is C44H58N8O5.
What is the molecular weight of 1hvj?
The molecular weight of 1hvj is 778.45 g/mol.
Where can I buy 1hvj?
You can request a quote for 1hvj directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1hvj?
Yes, KEHONG BIO provides custom synthesis services for 1hvj and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.