BAS 13558745
TL;DR: BAS 13558745 (CAS 878440-53-0) is a chemical compound with molecular formula C16H15ClN4O4 and molecular weight 362.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-1,3-dimethyl-2,4,7-trioxo-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-5-carboxamide
Also Known As: BAS 13558745, N-(4-chlorophenyl)-1,3-dimethyl-2,4,7-trioxo-1,2,3,4,5,6,7,8-octahydropyrido[2,3-d]pyrimidine-5-carboxamide, (1,3-dimethyl-2,4,7-trioxo(1,3,5,6,8-pentahydro-8-azaquinazolin-5-yl))-N-(4-ch lorophenyl)carboxamide, N-(4-CHLOROPHENYL)-1,3-DIMETHYL-2,4,7-TRIOXO-1H,2H,3H,4H,5H,6H,7H,8H-PYRIDO[2,3-D]PYRIMIDINE-5-CARBOXAMIDE, N-(4-chlorophenyl)-1,3-dimethyl-2,4,7-trioxo-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-5-carboxamide
| Molecular Formula | C16H15ClN4O4 |
|---|---|
| Molecular Weight | 362.08 g/mol |
| LogP | 0.8019 |
| Topological Polar Surface Area | 102.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 362.0782 |
| Heavy Atoms | 25 |
| Complexity | 990.9199 |
Chemical Identifiers
| CAS Number | 878440-53-0 |
|---|---|
| SMILES | CN1C2=C(C(CC(=O)N2)C(=O)NC3=CC=C(C=C3)Cl)C(=O)N(C1=O)C |
Product Overview
BAS 13558745 (CAS 878440-53-0), with molecular formula C16H15ClN4O4 and molecular weight 362.08 g/mol. IUPAC: N-(4-chlorophenyl)-1,3-dimethyl-2,4,7-trioxo-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-5-carboxamide.
Chemical Property Profile of BAS 13558745
Property Insights of BAS 13558745
The XLogP value of 0.8019 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 13558745. The TPSA of 102.2 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13558745. Following Lipinski's Rule of Five, BAS 13558745 has 2 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 BAS 13558745?
The CAS number of BAS 13558745 is 878440-53-0.
What is the molecular formula of BAS 13558745?
The molecular formula of BAS 13558745 is C16H15ClN4O4.
What is the molecular weight of BAS 13558745?
The molecular weight of BAS 13558745 is 362.08 g/mol.
Where can I buy BAS 13558745?
You can request a quote for BAS 13558745 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13558745?
Yes, KEHONG BIO provides custom synthesis services for BAS 13558745 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.