BAS 13558744
TL;DR: BAS 13558744 (CAS 878440-52-9) is a chemical compound with molecular formula C16H14Cl2N4O4 and molecular weight 396.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-dichlorophenyl)-1,3-dimethyl-2,4,7-trioxo-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-5-carboxamide
Also Known As: BAS 13558744, N-(3,4-dichlorophenyl)-1,3-dimethyl-2,4,7-trioxo-1,2,3,4,5,6,7,8-octahydropyrido[2,3-d]pyrimidine-5-carboxamide, N-(3,4-dichlorophenyl)(1,3-dimethyl-2,4,7-trioxo(1,3,5,6,8-pentahydro-8-azaqui nazolin-5-yl))carboxamide, N-(3,4-DICHLOROPHENYL)-1,3-DIMETHYL-2,4,7-TRIOXO-1H,2H,3H,4H,5H,6H,7H,8H-PYRIDO[2,3-D]PYRIMIDINE-5-CARBOXAMIDE, N-(3,4-dichlorophenyl)-1,3-dimethyl-2,4,7-trioxo-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-5-carboxamide
| Molecular Formula | C16H14Cl2N4O4 |
|---|---|
| Molecular Weight | 396.04 g/mol |
| LogP | 1.4553 |
| Topological Polar Surface Area | 102.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 396.0392 |
| Heavy Atoms | 26 |
| Complexity | 1057.436 |
Chemical Identifiers
| CAS Number | 878440-52-9 |
|---|---|
| SMILES | CN1C2=C(C(CC(=O)N2)C(=O)NC3=CC(=C(C=C3)Cl)Cl)C(=O)N(C1=O)C |
Product Overview
BAS 13558744 (CAS 878440-52-9), with molecular formula C16H14Cl2N4O4 and molecular weight 396.04 g/mol. IUPAC: N-(3,4-dichlorophenyl)-1,3-dimethyl-2,4,7-trioxo-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-5-carboxamide.
Chemical Property Profile of BAS 13558744
Property Insights of BAS 13558744
The XLogP value of 1.4553 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 13558744. The TPSA of 102.2 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13558744. Following Lipinski's Rule of Five, BAS 13558744 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 13558744?
The CAS number of BAS 13558744 is 878440-52-9.
What is the molecular formula of BAS 13558744?
The molecular formula of BAS 13558744 is C16H14Cl2N4O4.
What is the molecular weight of BAS 13558744?
The molecular weight of BAS 13558744 is 396.04 g/mol.
Where can I buy BAS 13558744?
You can request a quote for BAS 13558744 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13558744?
Yes, KEHONG BIO provides custom synthesis services for BAS 13558744 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.