AB00086384-01
TL;DR: AB00086384-01 (CAS 299407-29-7) is a chemical compound with molecular formula C18H18N2O6 and molecular weight 358.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(4-hydroxy-3-nitrophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: AB00086384-01, methyl 4-(4-hydroxy-3-nitrophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, methyl 4-(4-hydroxy-3-nitrophenyl)-2-methyl-5-oxo-1,4,6,7,8-pentahydroquinolin e-3-carboxylate, methyl 4-(4-hydroxy-3-nitrophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, methyl 4-{4-hydroxy-3-nitrophenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
| Molecular Formula | C18H18N2O6 |
|---|---|
| Molecular Weight | 358.12 g/mol |
| LogP | 2.4413 |
| Topological Polar Surface Area | 118.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 358.1165 |
| Heavy Atoms | 26 |
| Complexity | 883.66754 |
Chemical Identifiers
| CAS Number | 299407-29-7 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)O)[N+](=O)[O-])C(=O)OC |
Product Overview
AB00086384-01 (CAS 299407-29-7), with molecular formula C18H18N2O6 and molecular weight 358.12 g/mol. IUPAC: methyl 4-(4-hydroxy-3-nitrophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of AB00086384-01
Property Insights of AB00086384-01
The XLogP value of 2.4413 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00086384-01. The TPSA of 118.77 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00086384-01. Following Lipinski's Rule of Five, AB00086384-01 has 2 hydrogen bond donor(s) and 7 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 AB00086384-01?
The CAS number of AB00086384-01 is 299407-29-7.
What is the molecular formula of AB00086384-01?
The molecular formula of AB00086384-01 is C18H18N2O6.
What is the molecular weight of AB00086384-01?
The molecular weight of AB00086384-01 is 358.12 g/mol.
Where can I buy AB00086384-01?
You can request a quote for AB00086384-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00086384-01?
Yes, KEHONG BIO provides custom synthesis services for AB00086384-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.