AB00117373-01
TL;DR: AB00117373-01 (CAS 474005-46-4) is a chemical compound with molecular formula C18H13Cl2F3N2O3 and molecular weight 432.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzoyl-6-(3,4-dichlorophenyl)-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one
Also Known As: AB00117373-01, 5-benzoyl-6-(3,4-dichlorophenyl)-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one, 5-benzoyl-6-(3,4-dichlorophenyl)-4-hydroxy-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one, [6-(3,4-dichlorophenyl)-2,4-dihydroxy-4-(trifluoromethyl)-1,4,5,6-tetrahydropyrimidin-5-yl](phenyl)methanone, 6-(3,4-dichlorophenyl)-4-hydroxy-5-(phenylcarbonyl)-4-(trifluoromethyl)-1,3-di azaperhydroin-2-one
| Molecular Formula | C18H13Cl2F3N2O3 |
|---|---|
| Molecular Weight | 432.03 g/mol |
| LogP | 4.0973 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 432.02554 |
| Heavy Atoms | 28 |
| Complexity | 924.037 |
Chemical Identifiers
| CAS Number | 474005-46-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2C(NC(=O)NC2(C(F)(F)F)O)C3=CC(=C(C=C3)Cl)Cl |
Product Overview
AB00117373-01 (CAS 474005-46-4), with molecular formula C18H13Cl2F3N2O3 and molecular weight 432.03 g/mol. IUPAC: 5-benzoyl-6-(3,4-dichlorophenyl)-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one.
Chemical Property Profile of AB00117373-01
Property Insights of AB00117373-01
The XLogP value of 4.0973 indicates that AB00117373-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00117373-01. Following Lipinski's Rule of Five, AB00117373-01 has 3 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 AB00117373-01?
The CAS number of AB00117373-01 is 474005-46-4.
What is the molecular formula of AB00117373-01?
The molecular formula of AB00117373-01 is C18H13Cl2F3N2O3.
What is the molecular weight of AB00117373-01?
The molecular weight of AB00117373-01 is 432.03 g/mol.
Where can I buy AB00117373-01?
You can request a quote for AB00117373-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00117373-01?
Yes, KEHONG BIO provides custom synthesis services for AB00117373-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.