1-(2-Morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea
TL;DR: 1-(2-Morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea (CAS 337531-29-0) is a chemical compound with molecular formula C13H18N4O3S and molecular weight 310.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea
Also Known As: 1-[2-(morpholin-4-yl)ethyl]-3-(4-nitrophenyl)thiourea, 1-(2-morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea, 1-(2-Morpholinoethyl)-3-(4-nitrophenyl)thiourea, N-(2-morpholinoethyl)-N'-(4-nitrophenyl)thiourea, ((2-MORPHOLIN-4-YLETHYL)AMINO)((4-NITROPHENYL)AMINO)METHANE-1-THIONE
| Molecular Formula | C13H18N4O3S |
|---|---|
| Molecular Weight | 310.11 g/mol |
| LogP | 1.2134 |
| Topological Polar Surface Area | 79.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 310.10995 |
| Heavy Atoms | 21 |
| Complexity | 488.69467 |
Chemical Identifiers
| CAS Number | 337531-29-0 |
|---|---|
| SMILES | C1COCCN1CCNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
1-(2-Morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea (CAS 337531-29-0), with molecular formula C13H18N4O3S and molecular weight 310.11 g/mol. IUPAC: 1-(2-morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea.
Chemical Property Profile of 1-(2-Morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea
Property Insights of 1-(2-Morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea
The XLogP value of 1.2134 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea. The TPSA of 79.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea. Following Lipinski's Rule of Five, 1-(2-Morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea has 2 hydrogen bond donor(s) and 5 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-Morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea?
The CAS number of 1-(2-Morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea is 337531-29-0.
What is the molecular formula of 1-(2-Morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea?
The molecular formula of 1-(2-Morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea is C13H18N4O3S.
What is the molecular weight of 1-(2-Morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea?
The molecular weight of 1-(2-Morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea is 310.11 g/mol.
Where can I buy 1-(2-Morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea?
You can request a quote for 1-(2-Morpholin-4-ylethyl)-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-(2-Morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Morpholin-4-ylethyl)-3-(4-nitrophenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.