ChemDiv1_020614
TL;DR: ChemDiv1_020614 (CAS 330672-32-7) is a chemical compound with molecular formula C17H16ClN3O4 and molecular weight 361.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-(2-chlorophenyl)-7-methyl-2,4-dioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate
Also Known As: ChemDiv1_020614, AB00673077-01, AE-848/11485097, F1057-0634, ethyl 5-(2-chlorophenyl)-7-methyl-2,4-dioxo-1,2,3,4,5,8-hexahydropyrido[2,3-d]pyrimidine-6-carboxylate
| Molecular Formula | C17H16ClN3O4 |
|---|---|
| Molecular Weight | 361.08 g/mol |
| LogP | 2.1111 |
| Topological Polar Surface Area | 104.05 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 361.08295 |
| Heavy Atoms | 25 |
| Complexity | 989.87286 |
Chemical Identifiers
| CAS Number | 330672-32-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3Cl)C(=O)NC(=O)N2)C |
Product Overview
ChemDiv1_020614 (CAS 330672-32-7), with molecular formula C17H16ClN3O4 and molecular weight 361.08 g/mol. IUPAC: ethyl 5-(2-chlorophenyl)-7-methyl-2,4-dioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate.
Chemical Property Profile of ChemDiv1_020614
Property Insights of ChemDiv1_020614
The XLogP value of 2.1111 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_020614. The TPSA of 104.05 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_020614. Following Lipinski's Rule of Five, ChemDiv1_020614 has 3 hydrogen bond donor(s) and 5 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_020614?
The CAS number of ChemDiv1_020614 is 330672-32-7.
What is the molecular formula of ChemDiv1_020614?
The molecular formula of ChemDiv1_020614 is C17H16ClN3O4.
What is the molecular weight of ChemDiv1_020614?
The molecular weight of ChemDiv1_020614 is 361.08 g/mol.
Where can I buy ChemDiv1_020614?
You can request a quote for ChemDiv1_020614 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_020614?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_020614 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.