BAS 01174229
TL;DR: BAS 01174229 (CAS 175980-75-3) is a chemical compound with molecular formula C20H14N4O6S and molecular weight 438.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-1,3-dioxoisoindole-5-carboxylic acid
Also Known As: BAS 01174229, BIM-0009777.P001, 2-(4-(N-(4-Methylpyrimidin-2-yl)sulfamoyl)phenyl)-1,3-dioxoisoindoline-5-carboxylic acid, 2-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-1,3-dioxoisoindole-5-carboxylic acid, 2-(4-{[(4-methyl-2-pyrimidinyl)amino]sulfonyl}phenyl)-1,3-dioxo-5-isoindolinecarboxylic acid
| Molecular Formula | C20H14N4O6S |
|---|---|
| Molecular Weight | 438.06 g/mol |
| LogP | 2.08462 |
| Topological Polar Surface Area | 146.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 438.06342 |
| Heavy Atoms | 31 |
| Complexity | 1352.338 |
Chemical Identifiers
| CAS Number | 175980-75-3 |
|---|---|
| SMILES | CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)O |
Product Overview
BAS 01174229 (CAS 175980-75-3), with molecular formula C20H14N4O6S and molecular weight 438.06 g/mol. IUPAC: 2-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-1,3-dioxoisoindole-5-carboxylic acid.
Chemical Property Profile of BAS 01174229
Property Insights of BAS 01174229
The XLogP value of 2.08462 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01174229. The TPSA of 146.63 Ų indicates high polarity, suggesting BAS 01174229 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 01174229 has 2 hydrogen bond donor(s) and 7 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 01174229?
The CAS number of BAS 01174229 is 175980-75-3.
What is the molecular formula of BAS 01174229?
The molecular formula of BAS 01174229 is C20H14N4O6S.
What is the molecular weight of BAS 01174229?
The molecular weight of BAS 01174229 is 438.06 g/mol.
Where can I buy BAS 01174229?
You can request a quote for BAS 01174229 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01174229?
Yes, KEHONG BIO provides custom synthesis services for BAS 01174229 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.