ChemDiv3_014763
TL;DR: ChemDiv3_014763 (CAS 846593-86-0) is a chemical compound with molecular formula C21H20ClNO3 and molecular weight 369.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-3,4-dimethyl-9-[(4-methylphenyl)methyl]-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-2-one
Also Known As: ChemDiv3_014763, EiM07-14642, IDI1_030561, 6-chloro-3,4-dimethyl-9-(4-methylbenzyl)-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one, 6-chloro-3,4-dimethyl-9-(4-methylbenzyl)-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one
| Molecular Formula | C21H20ClNO3 |
|---|---|
| Molecular Weight | 369.11 g/mol |
| LogP | 4.72376 |
| Topological Polar Surface Area | 42.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 369.11316 |
| Heavy Atoms | 26 |
| Complexity | 1053.7698 |
Chemical Identifiers
| CAS Number | 846593-86-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2CC3=C4C(=CC(=C3OC2)Cl)C(=C(C(=O)O4)C)C |
Product Overview
ChemDiv3_014763 (CAS 846593-86-0), with molecular formula C21H20ClNO3 and molecular weight 369.11 g/mol. IUPAC: 6-chloro-3,4-dimethyl-9-[(4-methylphenyl)methyl]-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-2-one.
Chemical Property Profile of ChemDiv3_014763
Property Insights of ChemDiv3_014763
The XLogP value of 4.72376 indicates that ChemDiv3_014763 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.68 Ų, ChemDiv3_014763 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_014763 has 0 hydrogen bond donor(s) and 4 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 ChemDiv3_014763?
The CAS number of ChemDiv3_014763 is 846593-86-0.
What is the molecular formula of ChemDiv3_014763?
The molecular formula of ChemDiv3_014763 is C21H20ClNO3.
What is the molecular weight of ChemDiv3_014763?
The molecular weight of ChemDiv3_014763 is 369.11 g/mol.
Where can I buy ChemDiv3_014763?
You can request a quote for ChemDiv3_014763 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_014763?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_014763 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.