AB00674341-01
TL;DR: AB00674341-01 (CAS 623936-47-0) is a chemical compound with molecular formula C18H13ClF4N2O3 and molecular weight 416.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzoyl-6-(2-chloro-6-fluorophenyl)-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one
Also Known As: AB00674341-01, F1423-1072, 5-benzoyl-6-(2-chloro-6-fluorophenyl)-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one, 5-benzoyl-6-(2-chloro-6-fluorophenyl)-4-hydroxy-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one, 5-BENZOYL-6-(2-CL-6-F-PH)-4-HO-4-(TRIFLUOROMETHYL)TETRAHYDRO-2(1H)-PYRIMIDINONE
| Molecular Formula | C18H13ClF4N2O3 |
|---|---|
| Molecular Weight | 416.06 g/mol |
| LogP | 3.583 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 416.05508 |
| Heavy Atoms | 28 |
| Complexity | 902.5419 |
Chemical Identifiers
| CAS Number | 623936-47-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2C(NC(=O)NC2(C(F)(F)F)O)C3=C(C=CC=C3Cl)F |
Product Overview
AB00674341-01 (CAS 623936-47-0), with molecular formula C18H13ClF4N2O3 and molecular weight 416.06 g/mol. IUPAC: 5-benzoyl-6-(2-chloro-6-fluorophenyl)-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one.
Chemical Property Profile of AB00674341-01
Property Insights of AB00674341-01
The XLogP value of 3.583 indicates that AB00674341-01 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 AB00674341-01. Following Lipinski's Rule of Five, AB00674341-01 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 AB00674341-01?
The CAS number of AB00674341-01 is 623936-47-0.
What is the molecular formula of AB00674341-01?
The molecular formula of AB00674341-01 is C18H13ClF4N2O3.
What is the molecular weight of AB00674341-01?
The molecular weight of AB00674341-01 is 416.06 g/mol.
Where can I buy AB00674341-01?
You can request a quote for AB00674341-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00674341-01?
Yes, KEHONG BIO provides custom synthesis services for AB00674341-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.