AB00722442-01
TL;DR: AB00722442-01 (CAS 732989-62-7) is a chemical compound with molecular formula C19H15Cl2N3O5 and molecular weight 435.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(3,4-dichloroanilino)-2-oxoethyl] 3-(2-hydroxyethyl)-4-oxophthalazine-1-carboxylate
Also Known As: AB00722442-01, [2-(3,4-dichloroanilino)-2-oxoethyl] 3-(2-hydroxyethyl)-4-oxophthalazine-1-carboxylate, (3,4-dichlorophenyl)carbamoylmethyl 3-(2-hydroxyethyl)-4-oxo-phthalazine-1-carboxylate, 2-(3,4-Dichloroanilino)-2-oxoethyl 3-(2-hydroxyethyl)-4-oxo-3,4-dihydrophthalazine-1-carboxylate
| Molecular Formula | C19H15Cl2N3O5 |
|---|---|
| Molecular Weight | 435.04 g/mol |
| LogP | 2.4911 |
| Topological Polar Surface Area | 110.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 435.03888 |
| Heavy Atoms | 29 |
| Complexity | 1146.383 |
Chemical Identifiers
| CAS Number | 732989-62-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=NN(C2=O)CCO)C(=O)OCC(=O)NC3=CC(=C(C=C3)Cl)Cl |
Product Overview
AB00722442-01 (CAS 732989-62-7), with molecular formula C19H15Cl2N3O5 and molecular weight 435.04 g/mol. IUPAC: [2-(3,4-dichloroanilino)-2-oxoethyl] 3-(2-hydroxyethyl)-4-oxophthalazine-1-carboxylate.
Chemical Property Profile of AB00722442-01
Property Insights of AB00722442-01
The XLogP value of 2.4911 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00722442-01. The TPSA of 110.52 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00722442-01. Following Lipinski's Rule of Five, AB00722442-01 has 2 hydrogen bond donor(s) and 6 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 AB00722442-01?
The CAS number of AB00722442-01 is 732989-62-7.
What is the molecular formula of AB00722442-01?
The molecular formula of AB00722442-01 is C19H15Cl2N3O5.
What is the molecular weight of AB00722442-01?
The molecular weight of AB00722442-01 is 435.04 g/mol.
Where can I buy AB00722442-01?
You can request a quote for AB00722442-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00722442-01?
Yes, KEHONG BIO provides custom synthesis services for AB00722442-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.