AN-989/40663974
TL;DR: AN-989/40663974 (CAS 428504-24-9) is a chemical compound with molecular formula C21H18N4O4S and molecular weight 422.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[(Z)-[1-(4-methylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]pyrrol-1-yl]benzenesulfonamide
Also Known As: AN-989/40663974, 4-[2-[(Z)-[1-(4-methylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]pyrrol-1-yl]benzenesulfonamide, 4-(2-{(Z)-[1-(4-methylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}-1H-pyrrol-1-yl)benzenesulfonamide, 4-(2-{(Z)-[3-hydroxy-1-(4-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-1H-pyrrol-1-yl)benzenesulfonamide, 4-(2-{[(4Z)-1-(4-METHYLPHENYL)-3,5-DIOXOPYRAZOLIDIN-4-YLIDENE]METHYL}-1H-PYRROL-1-YL)BENZENE-1-SULFONAMIDE
| Molecular Formula | C21H18N4O4S |
|---|---|
| Molecular Weight | 422.10 g/mol |
| LogP | 1.89452 |
| Topological Polar Surface Area | 114.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 422.1049 |
| Heavy Atoms | 30 |
| Complexity | 1273.3004 |
Chemical Identifiers
| CAS Number | 428504-24-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)/C(=C\C3=CC=CN3C4=CC=C(C=C4)S(=O)(=O)N)/C(=O)N2 |
Product Overview
AN-989/40663974 (CAS 428504-24-9), with molecular formula C21H18N4O4S and molecular weight 422.10 g/mol. IUPAC: 4-[2-[(Z)-[1-(4-methylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]pyrrol-1-yl]benzenesulfonamide.
Chemical Property Profile of AN-989/40663974
Property Insights of AN-989/40663974
The XLogP value of 1.89452 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-989/40663974. The TPSA of 114.5 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-989/40663974. Following Lipinski's Rule of Five, AN-989/40663974 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 AN-989/40663974?
The CAS number of AN-989/40663974 is 428504-24-9.
What is the molecular formula of AN-989/40663974?
The molecular formula of AN-989/40663974 is C21H18N4O4S.
What is the molecular weight of AN-989/40663974?
The molecular weight of AN-989/40663974 is 422.10 g/mol.
Where can I buy AN-989/40663974?
You can request a quote for AN-989/40663974 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-989/40663974?
Yes, KEHONG BIO provides custom synthesis services for AN-989/40663974 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.