![Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]- structure](/static/products/568/5683-46-5.png)
Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]-
TL;DR: Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]- (CAS 5683-46-5) is a chemical compound with molecular formula C14H11N3O3S and molecular weight 301.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-N-(phenylcarbamothioyl)benzamide
Also Known As: 1-nitroethenylbenzene, 1-(4-Nitrobenzoyl)-3-phenylthiourea, 1-(4-Nitro-benzoyl)-3-phenyl-thiourea, 4-nitro-n-(phenylcarbamothioyl)benzamide, 3-(4-NITROBENZOYL)-1-PHENYLTHIOUREA
| Molecular Formula | C14H11N3O3S |
|---|---|
| Molecular Weight | 301.05 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 301.05212 |
| Heavy Atoms | 21 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 5683-46-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | CLUCQDRQMGVTGD-UHFFFAOYSA-N |
Product Overview
Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]- (CAS 5683-46-5), with molecular formula C14H11N3O3S and molecular weight 301.05 g/mol. IUPAC: 4-nitro-N-(phenylcarbamothioyl)benzamide.
Chemical Property Profile of Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]-
Property Insights of Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]-
The XLogP value of 3.8 indicates that Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]-. Following Lipinski's Rule of Five, Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]- 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 Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]-?
The CAS number of Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]- is 5683-46-5.
What is the molecular formula of Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]-?
The molecular formula of Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]- is C14H11N3O3S.
What is the molecular weight of Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]-?
The molecular weight of Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]- is 301.05 g/mol.
Where can I buy Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]-?
You can request a quote for Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]-?
Yes, KEHONG BIO provides custom synthesis services for Benzamide, 4-nitro-N-[(phenylamino)thioxomethyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.