2-(苯甲酰氨基)苯基4-硝基苯磺酸酯
TL;DR: 2-(苯甲酰氨基)苯基4-硝基苯磺酸酯 (CAS 18631-74-8) is a chemical compound with molecular formula C19H14N2O6S and molecular weight 398.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(苯甲酰氨基)苯基4-硝基苯磺酸酯
(2-benzamidophenyl) 4-nitrobenzenesulfonate
Also Known As: 2-(benzoylamino)phenyl 4-nitrobenzenesulfonate, (2-benzamidophenyl) 4-nitrobenzenesulfonate, 2-Benzamidophenyl 4-nitrobenzene-1-sulfonate, N-[2-(4-NITROPHENYL)SULFONYLOXYPHENYL]BENZAMIDE
| Molecular Formula | C19H14N2O6S |
|---|---|
| Molecular Weight | 398.06 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.05725 |
| Heavy Atoms | 28 |
| Complexity | 642.0 |
Chemical Identifiers
| CAS Number | 18631-74-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | AQPWYOPDJFOYLT-UHFFFAOYSA-N |
Product Overview
2-(苯甲酰氨基)苯基4-硝基苯磺酸酯 (CAS 18631-74-8), with molecular formula C19H14N2O6S and molecular weight 398.06 g/mol. IUPAC: (2-benzamidophenyl) 4-nitrobenzenesulfonate.
Chemical Property Profile of 2-(苯甲酰氨基)苯基4-硝基苯磺酸酯
Property Insights of 2-(苯甲酰氨基)苯基4-硝基苯磺酸酯
The XLogP value of 3.7 indicates that 2-(苯甲酰氨基)苯基4-硝基苯磺酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(苯甲酰氨基)苯基4-硝基苯磺酸酯. Following Lipinski's Rule of Five, 2-(苯甲酰氨基)苯基4-硝基苯磺酸酯 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 2-(苯甲酰氨基)苯基4-硝基苯磺酸酯?
The CAS number of 2-(苯甲酰氨基)苯基4-硝基苯磺酸酯 is 18631-74-8.
What is the molecular formula of 2-(苯甲酰氨基)苯基4-硝基苯磺酸酯?
The molecular formula of 2-(苯甲酰氨基)苯基4-硝基苯磺酸酯 is C19H14N2O6S.
What is the molecular weight of 2-(苯甲酰氨基)苯基4-硝基苯磺酸酯?
The molecular weight of 2-(苯甲酰氨基)苯基4-硝基苯磺酸酯 is 398.06 g/mol.
Where can I buy 2-(苯甲酰氨基)苯基4-硝基苯磺酸酯?
You can request a quote for 2-(苯甲酰氨基)苯基4-硝基苯磺酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(苯甲酰氨基)苯基4-硝基苯磺酸酯?
Yes, KEHONG BIO provides custom synthesis services for 2-(苯甲酰氨基)苯基4-硝基苯磺酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.