BAS 07338436
TL;DR: BAS 07338436 (CAS 442568-80-1) is a chemical compound with molecular formula C19H12N4O5 and molecular weight 376.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(9,10-dioxoanthracen-1-yl)-1-methyl-4-nitropyrazole-3-carboxamide
Also Known As: BAS 07338436, N-(9,10-dioxo-9,10-dihydroanthracen-1-yl)-1-methyl-4-nitro-1H-pyrazole-3-carboxamide, N-(9,10-dioxoanthracen-1-yl)-1-methyl-4-nitropyrazole-3-carboxamide
| Molecular Formula | C19H12N4O5 |
|---|---|
| Molecular Weight | 376.08 g/mol |
| LogP | 2.356 |
| Topological Polar Surface Area | 124.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 376.08078 |
| Heavy Atoms | 28 |
| Complexity | 1194.7847 |
Chemical Identifiers
| CAS Number | 442568-80-1 |
|---|---|
| SMILES | CN1C=C(C(=N1)C(=O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-] |
Product Overview
BAS 07338436 (CAS 442568-80-1), with molecular formula C19H12N4O5 and molecular weight 376.08 g/mol. IUPAC: N-(9,10-dioxoanthracen-1-yl)-1-methyl-4-nitropyrazole-3-carboxamide.
Chemical Property Profile of BAS 07338436
Property Insights of BAS 07338436
The XLogP value of 2.356 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07338436. The TPSA of 124.2 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07338436. Following Lipinski's Rule of Five, BAS 07338436 has 1 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 BAS 07338436?
The CAS number of BAS 07338436 is 442568-80-1.
What is the molecular formula of BAS 07338436?
The molecular formula of BAS 07338436 is C19H12N4O5.
What is the molecular weight of BAS 07338436?
The molecular weight of BAS 07338436 is 376.08 g/mol.
Where can I buy BAS 07338436?
You can request a quote for BAS 07338436 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07338436?
Yes, KEHONG BIO provides custom synthesis services for BAS 07338436 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.