C19-H13-Cl2-N3-O2
TL;DR: C19-H13-Cl2-N3-O2 (CAS 75660-48-9) is a chemical compound with molecular formula C19H13Cl2N3O2 and molecular weight 385.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-bis(2-chlorophenyl)-2-(2-hydroxyethyl)-3-oxopyridazine-4-carbonitrile
Also Known As: 4-Pyridazinecarbonitrile, 5,6-bis(2-chlorophenyl)-2,3-dihydro-2-(2-hydroxyethyl)-3-oxo-, 4-PYRIDAZINECARBONITRILE,5,6-BIS(2-CHLOROPHENYL)-2,3-DIHYDRO-2-(2-HYDROXYETHYL)-3-OXO-, 5,6-bis(2-chlorophenyl)-2-(2-hydroxyethyl)-3-oxopyridazine-4, 5,6-bis(2-chlorophenyl)-2-(2-hydroxyethyl)-3-oxopyridazine-4-carbonitrile, 5,6-bis(2-chlorophenyl)-2-(2-hydroxyethyl)-3-oxo-2,3-dihydropyridazine-4-carbonitrile
| Molecular Formula | C19H13Cl2N3O2 |
|---|---|
| Molecular Weight | 385.04 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 385.03848 |
| Heavy Atoms | 26 |
| Complexity | 667.0 |
Chemical Identifiers
| CAS Number | 75660-48-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=C(C(=O)N(N=C2C3=CC=CC=C3Cl)CCO)C#N)Cl |
| InChIKey | OBHKGLRTZUIUQY-UHFFFAOYSA-N |
Product Overview
C19-H13-Cl2-N3-O2 (CAS 75660-48-9), with molecular formula C19H13Cl2N3O2 and molecular weight 385.04 g/mol. IUPAC: 5,6-bis(2-chlorophenyl)-2-(2-hydroxyethyl)-3-oxopyridazine-4-carbonitrile.
Chemical Property Profile of C19-H13-Cl2-N3-O2
Property Insights of C19-H13-Cl2-N3-O2
The XLogP value of 3.6 indicates that C19-H13-Cl2-N3-O2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for C19-H13-Cl2-N3-O2. Following Lipinski's Rule of Five, C19-H13-Cl2-N3-O2 has 1 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 C19-H13-Cl2-N3-O2?
The CAS number of C19-H13-Cl2-N3-O2 is 75660-48-9.
What is the molecular formula of C19-H13-Cl2-N3-O2?
The molecular formula of C19-H13-Cl2-N3-O2 is C19H13Cl2N3O2.
What is the molecular weight of C19-H13-Cl2-N3-O2?
The molecular weight of C19-H13-Cl2-N3-O2 is 385.04 g/mol.
Where can I buy C19-H13-Cl2-N3-O2?
You can request a quote for C19-H13-Cl2-N3-O2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C19-H13-Cl2-N3-O2?
Yes, KEHONG BIO provides custom synthesis services for C19-H13-Cl2-N3-O2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.