1,1-Diethyl-3-(4-nitrophenyl)thiourea
TL;DR: 1,1-Diethyl-3-(4-nitrophenyl)thiourea (CAS 24718-72-7) is a chemical compound with molecular formula C11H15N3O2S and molecular weight 253.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-diethyl-3-(4-nitrophenyl)thiourea
Also Known As: 1,1-diethyl-3-(4-nitrophenyl)thiourea, N,N-diethyl-N'-(4-nitrophenyl)thiourea, AB00114385-01
| Molecular Formula | C11H15N3O2S |
|---|---|
| Molecular Weight | 253.09 g/mol |
| LogP | 2.6334 |
| Topological Polar Surface Area | 58.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 253.0885 |
| Heavy Atoms | 17 |
| Complexity | 401.6825 |
Chemical Identifiers
| CAS Number | 24718-72-7 |
|---|---|
| SMILES | CCN(CC)C(=S)NC1=CC=C(C=C1)[N+](=O)[O-] |
Product Overview
1,1-Diethyl-3-(4-nitrophenyl)thiourea (CAS 24718-72-7), with molecular formula C11H15N3O2S and molecular weight 253.09 g/mol. IUPAC: 1,1-diethyl-3-(4-nitrophenyl)thiourea.
Chemical Property Profile of 1,1-Diethyl-3-(4-nitrophenyl)thiourea
Property Insights of 1,1-Diethyl-3-(4-nitrophenyl)thiourea
The XLogP value of 2.6334 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Diethyl-3-(4-nitrophenyl)thiourea. With a topological polar surface area (TPSA) of 58.41 Ų, 1,1-Diethyl-3-(4-nitrophenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Diethyl-3-(4-nitrophenyl)thiourea has 1 hydrogen bond donor(s) and 3 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 1,1-Diethyl-3-(4-nitrophenyl)thiourea?
The CAS number of 1,1-Diethyl-3-(4-nitrophenyl)thiourea is 24718-72-7.
What is the molecular formula of 1,1-Diethyl-3-(4-nitrophenyl)thiourea?
The molecular formula of 1,1-Diethyl-3-(4-nitrophenyl)thiourea is C11H15N3O2S.
What is the molecular weight of 1,1-Diethyl-3-(4-nitrophenyl)thiourea?
The molecular weight of 1,1-Diethyl-3-(4-nitrophenyl)thiourea is 253.09 g/mol.
Where can I buy 1,1-Diethyl-3-(4-nitrophenyl)thiourea?
You can request a quote for 1,1-Diethyl-3-(4-nitrophenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Diethyl-3-(4-nitrophenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Diethyl-3-(4-nitrophenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.