Cgp 12177-nbd
TL;DR: Cgp 12177-nbd (CAS 116475-05-9) is a chemical compound with molecular formula C20H23N7O6 and molecular weight 457.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-hydroxy-3-[[2-methyl-1-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]propan-2-yl]amino]propoxy]-1,3-dihydrobenzimidazol-2-one
Also Known As: Cgp 12177-nbd, Cgp-12177-nbd, 4-[2-hydroxy-3-[[2-methyl-1-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]propan-2-yl]amino]propoxy]-1,3-dihydrobenzimidazol-2-one, 2-(1-(2-(2(1H)-Benzimidazolone-4-yl-oxy)-2-hydroxypropyl)-3-amino)-1-(7-nitrobenzofurazane-4-yl-amino)-2-methylpropane, 2H-Benzimidazol-2-one, 4-(3-((1,1-dimethyl-2-((7-nitro-4-benzofurazanyl)amino)ethyl)amino)-2-hydroxypropoxy)-1,3-dihydro-
| Molecular Formula | C20H23N7O6 |
|---|---|
| Molecular Weight | 457.17 g/mol |
| LogP | 1.5206 |
| Topological Polar Surface Area | 184.23 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 457.171 |
| Heavy Atoms | 33 |
| Complexity | 1341.682 |
Chemical Identifiers
| CAS Number | 116475-05-9 |
|---|---|
| SMILES | CC(C)(CNC1=CC=C(C2=NON=C12)[N+](=O)[O-])NCC(COC3=CC=CC4=C3NC(=O)N4)O |
Product Overview
Cgp 12177-nbd (CAS 116475-05-9), with molecular formula C20H23N7O6 and molecular weight 457.17 g/mol. IUPAC: 4-[2-hydroxy-3-[[2-methyl-1-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]propan-2-yl]amino]propoxy]-1,3-dihydrobenzimidazol-2-one.
Chemical Property Profile of Cgp 12177-nbd
Property Insights of Cgp 12177-nbd
The XLogP value of 1.5206 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cgp 12177-nbd. The TPSA of 184.23 Ų indicates high polarity, suggesting Cgp 12177-nbd may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cgp 12177-nbd has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cgp 12177-nbd?
The CAS number of Cgp 12177-nbd is 116475-05-9.
What is the molecular formula of Cgp 12177-nbd?
The molecular formula of Cgp 12177-nbd is C20H23N7O6.
What is the molecular weight of Cgp 12177-nbd?
The molecular weight of Cgp 12177-nbd is 457.17 g/mol.
Where can I buy Cgp 12177-nbd?
You can request a quote for Cgp 12177-nbd directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cgp 12177-nbd?
Yes, KEHONG BIO provides custom synthesis services for Cgp 12177-nbd and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.