![1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea structure](/static/products/7657/76572-69-5.webp)
1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea
TL;DR: 1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea (CAS 76572-69-5) is a chemical compound with molecular formula C14H12N4O2S and molecular weight 300.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-nitrophenyl)methylideneamino]-3-phenylthiourea
Also Known As: 2-nitrobenzaldehyde N-phenylthiosemicarbazone, 1-[(2-nitrophenyl)methylideneamino]-3-phenylthiourea
| Molecular Formula | C14H12N4O2S |
|---|---|
| Molecular Weight | 300.07 g/mol |
| LogP | 2.9153 |
| Topological Polar Surface Area | 79.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.06808 |
| Heavy Atoms | 21 |
| Complexity | 673.684 |
Chemical Identifiers
| CAS Number | 76572-69-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=S)NN=CC2=CC=CC=C2[N+](=O)[O-] |
Product Overview
1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea (CAS 76572-69-5), with molecular formula C14H12N4O2S and molecular weight 300.07 g/mol. IUPAC: 1-[(2-nitrophenyl)methylideneamino]-3-phenylthiourea.
Chemical Property Profile of 1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea
Property Insights of 1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea
The XLogP value of 2.9153 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea. The TPSA of 79.56 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea. Following Lipinski's Rule of Five, 1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea 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 1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea?
The CAS number of 1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea is 76572-69-5.
What is the molecular formula of 1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea?
The molecular formula of 1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea is C14H12N4O2S.
What is the molecular weight of 1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea?
The molecular weight of 1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea is 300.07 g/mol.
Where can I buy 1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea?
You can request a quote for 1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2-Nitrophenyl)methylideneamino]-3-phenylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.