6-chloropyridazine-3-carbaldehyde
TL;DR: 6-chloropyridazine-3-carbaldehyde (CAS 10190-93-9) is a chemical compound with molecular formula C21H31NO4 and molecular weight 361.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-(17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ylidene)amino]oxyacetic acid
Also Known As: 6-chloropyridazine-3-carbaldehyde, 2-[(E)-(17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ylidene)amino]oxyacetic acid
| Molecular Formula | C21H31NO4 |
|---|---|
| Molecular Weight | 361.23 g/mol |
| LogP | 3.7673 |
| Topological Polar Surface Area | 79.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 361.2253 |
| Heavy Atoms | 26 |
| Complexity | 656.39655 |
Chemical Identifiers
| CAS Number | 10190-93-9 |
|---|---|
| SMILES | CC12CCC3C(C1CCC2O)CCC4=C/C(=N/OCC(=O)O)/CCC34C |
Product Overview
6-chloropyridazine-3-carbaldehyde (CAS 10190-93-9), with molecular formula C21H31NO4 and molecular weight 361.23 g/mol. IUPAC: 2-[(E)-(17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ylidene)amino]oxyacetic acid.
Chemical Property Profile of 6-chloropyridazine-3-carbaldehyde
Property Insights of 6-chloropyridazine-3-carbaldehyde
The XLogP value of 3.7673 indicates that 6-chloropyridazine-3-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-chloropyridazine-3-carbaldehyde. Following Lipinski's Rule of Five, 6-chloropyridazine-3-carbaldehyde 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 6-chloropyridazine-3-carbaldehyde?
The CAS number of 6-chloropyridazine-3-carbaldehyde is 10190-93-9.
What is the molecular formula of 6-chloropyridazine-3-carbaldehyde?
The molecular formula of 6-chloropyridazine-3-carbaldehyde is C21H31NO4.
What is the molecular weight of 6-chloropyridazine-3-carbaldehyde?
The molecular weight of 6-chloropyridazine-3-carbaldehyde is 361.23 g/mol.
Where can I buy 6-chloropyridazine-3-carbaldehyde?
You can request a quote for 6-chloropyridazine-3-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-chloropyridazine-3-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 6-chloropyridazine-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.