AB00119139-01
TL;DR: AB00119139-01 (CAS 431986-12-8) is a chemical compound with molecular formula C20H15BrN4O4S and molecular weight 486.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[(Z)-[1-(4-bromophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]pyrrol-1-yl]benzenesulfonamide
Also Known As: AB00119139-01, AN-465/15154294, 4-[2-[(Z)-[1-(4-bromophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]pyrrol-1-yl]benzenesulfonamide, 4-(2-{(Z)-[1-(4-bromophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}-1H-pyrrol-1-yl)benzenesulfonamide, 4-(2-{[(4Z)-1-(4-BROMOPHENYL)-3,5-DIOXOPYRAZOLIDIN-4-YLIDENE]METHYL}-1H-PYRROL-1-YL)BENZENE-1-SULFONAMIDE
| Molecular Formula | C20H15BrN4O4S |
|---|---|
| Molecular Weight | 486.00 g/mol |
| LogP | 2.3486 |
| Topological Polar Surface Area | 114.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 485.99973 |
| Heavy Atoms | 30 |
| Complexity | 1279.1005 |
Chemical Identifiers
| CAS Number | 431986-12-8 |
|---|---|
| SMILES | C1=CN(C(=C1)/C=C\2/C(=O)NN(C2=O)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)S(=O)(=O)N |
Product Overview
AB00119139-01 (CAS 431986-12-8), with molecular formula C20H15BrN4O4S and molecular weight 486.00 g/mol. IUPAC: 4-[2-[(Z)-[1-(4-bromophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]pyrrol-1-yl]benzenesulfonamide.
Chemical Property Profile of AB00119139-01
Property Insights of AB00119139-01
The XLogP value of 2.3486 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00119139-01. The TPSA of 114.5 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00119139-01. Following Lipinski's Rule of Five, AB00119139-01 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 AB00119139-01?
The CAS number of AB00119139-01 is 431986-12-8.
What is the molecular formula of AB00119139-01?
The molecular formula of AB00119139-01 is C20H15BrN4O4S.
What is the molecular weight of AB00119139-01?
The molecular weight of AB00119139-01 is 486.00 g/mol.
Where can I buy AB00119139-01?
You can request a quote for AB00119139-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00119139-01?
Yes, KEHONG BIO provides custom synthesis services for AB00119139-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.