![4-{[(二甲氨基)磺酰基]氨基}苯甲酸 structure](/static/products/902/90250-68-3.png)
4-{[(二甲氨基)磺酰基]氨基}苯甲酸
TL;DR: 4-{[(二甲氨基)磺酰基]氨基}苯甲酸 (CAS 90250-68-3) is a chemical compound with molecular formula C9H12N2O4S and molecular weight 244.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-{[(二甲氨基)磺酰基]氨基}苯甲酸
4-(dimethylsulfamoylamino)benzoic acid
Also Known As: 4-{[(dimethylamino)sulfonyl]amino}benzoic acid, Tolylfluanid metabolite, 4-(dimethylsulfamoylamino)benzoic acid, 4-[(dimethylsulfamoyl)amino]benzoic acid, TimTec1_006996
| Molecular Formula | C9H12N2O4S |
|---|---|
| Molecular Weight | 244.05 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 95.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.05177 |
| Heavy Atoms | 16 |
| Complexity | 339.0 |
Chemical Identifiers
| CAS Number | 90250-68-3 |
|---|---|
| SMILES | CN(C)S(=O)(=O)NC1=CC=C(C=C1)C(=O)O |
| InChIKey | GIHVRYUPCABTQW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-{[(二甲氨基)磺酰基]氨基}苯甲酸 (CAS 90250-68-3), with molecular formula C9H12N2O4S and molecular weight 244.05 g/mol. IUPAC: 4-(dimethylsulfamoylamino)benzoic acid.
Chemical Property Profile of 4-{[(二甲氨基)磺酰基]氨基}苯甲酸
Property Insights of 4-{[(二甲氨基)磺酰基]氨基}苯甲酸
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{[(二甲氨基)磺酰基]氨基}苯甲酸. The TPSA of 95.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(二甲氨基)磺酰基]氨基}苯甲酸. Following Lipinski's Rule of Five, 4-{[(二甲氨基)磺酰基]氨基}苯甲酸 has 2 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 4-{[(二甲氨基)磺酰基]氨基}苯甲酸?
The CAS number of 4-{[(二甲氨基)磺酰基]氨基}苯甲酸 is 90250-68-3.
What is the molecular formula of 4-{[(二甲氨基)磺酰基]氨基}苯甲酸?
The molecular formula of 4-{[(二甲氨基)磺酰基]氨基}苯甲酸 is C9H12N2O4S.
What is the molecular weight of 4-{[(二甲氨基)磺酰基]氨基}苯甲酸?
The molecular weight of 4-{[(二甲氨基)磺酰基]氨基}苯甲酸 is 244.05 g/mol.
Where can I buy 4-{[(二甲氨基)磺酰基]氨基}苯甲酸?
You can request a quote for 4-{[(二甲氨基)磺酰基]氨基}苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[(二甲氨基)磺酰基]氨基}苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 4-{[(二甲氨基)磺酰基]氨基}苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.