ChemDiv1_023549
TL;DR: ChemDiv1_023549 (CAS 347350-66-7) is a chemical compound with molecular formula C16H18ClNO3 and molecular weight 307.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-(2-chlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate
Also Known As: ChemDiv1_023549, MixCom6_002621, BIM-0047550.P001, A2386/0100978, isopropyl 4-(2-chlorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylate
| Molecular Formula | C16H18ClNO3 |
|---|---|
| Molecular Weight | 307.10 g/mol |
| LogP | 3.1691 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.09753 |
| Heavy Atoms | 21 |
| Complexity | 607.29456 |
Chemical Identifiers
| CAS Number | 347350-66-7 |
|---|---|
| SMILES | CC1=C(C(CC(=O)N1)C2=CC=CC=C2Cl)C(=O)OC(C)C |
Product Overview
ChemDiv1_023549 (CAS 347350-66-7), with molecular formula C16H18ClNO3 and molecular weight 307.10 g/mol. IUPAC: propan-2-yl 4-(2-chlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate.
Chemical Property Profile of ChemDiv1_023549
Property Insights of ChemDiv1_023549
The XLogP value of 3.1691 indicates that ChemDiv1_023549 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, ChemDiv1_023549 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_023549 has 1 hydrogen bond donor(s) and 3 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 ChemDiv1_023549?
The CAS number of ChemDiv1_023549 is 347350-66-7.
What is the molecular formula of ChemDiv1_023549?
The molecular formula of ChemDiv1_023549 is C16H18ClNO3.
What is the molecular weight of ChemDiv1_023549?
The molecular weight of ChemDiv1_023549 is 307.10 g/mol.
Where can I buy ChemDiv1_023549?
You can request a quote for ChemDiv1_023549 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_023549?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_023549 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.