(4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate
TL;DR: (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate (CAS 21975-86-0) is a chemical compound with molecular formula C14H11FN2O7S and molecular weight 370.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate
Also Known As: (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate, 4-Nitrophenyl [4-(fluorosulfonyl)-3-methoxyphenyl]carbamate, (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamat
| Molecular Formula | C14H11FN2O7S |
|---|---|
| Molecular Weight | 370.03 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 136.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 370.0271 |
| Heavy Atoms | 25 |
| Complexity | 581.0 |
Chemical Identifiers
| CAS Number | 21975-86-0 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)NC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)F |
| InChIKey | YWRPKGSCPCPXIK-UHFFFAOYSA-N |
Product Overview
(4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate (CAS 21975-86-0), with molecular formula C14H11FN2O7S and molecular weight 370.03 g/mol. IUPAC: (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate.
Chemical Property Profile of (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate
Property Insights of (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate. Following Lipinski's Rule of Five, (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate has 1 hydrogen bond donor(s) and 8 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-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate?
The CAS number of (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate is 21975-86-0.
What is the molecular formula of (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate?
The molecular formula of (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate is C14H11FN2O7S.
What is the molecular weight of (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate?
The molecular weight of (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate is 370.03 g/mol.
Where can I buy (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate?
You can request a quote for (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for (4-nitrophenyl) N-(4-fluorosulfonyl-3-methoxyphenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.