![1-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea structure](/static/products/852/852140-10-4.png)
1-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea
TL;DR: 1-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea (CAS 852140-10-4) is a chemical compound with molecular formula C18H18N4O2S and molecular weight 354.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(1,2-dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea
Also Known As: 1-[(1,2-dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea, 1-((1,2-dimethyl-1H-indol-5-yl)methyl)-3-(4-nitrophenyl)thiourea, F0651-0489, 3-[(1,2-DIMETHYL-1H-INDOL-5-YL)METHYL]-1-(4-NITROPHENYL)THIOUREA
| Molecular Formula | C18H18N4O2S |
|---|---|
| Molecular Weight | 354.12 g/mol |
| LogP | 3.88152 |
| Topological Polar Surface Area | 72.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 354.11505 |
| Heavy Atoms | 25 |
| Complexity | 947.6145 |
Chemical Identifiers
| CAS Number | 852140-10-4 |
|---|---|
| SMILES | CC1=CC2=C(N1C)C=CC(=C2)CNC(=S)NC3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
1-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea (CAS 852140-10-4), with molecular formula C18H18N4O2S and molecular weight 354.12 g/mol. IUPAC: 1-[(1,2-dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea.
Chemical Property Profile of 1-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea
Property Insights of 1-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea
The XLogP value of 3.88152 indicates that 1-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea. Following Lipinski's Rule of Five, 1-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea has 2 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-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea?
The CAS number of 1-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea is 852140-10-4.
What is the molecular formula of 1-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea?
The molecular formula of 1-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea is C18H18N4O2S.
What is the molecular weight of 1-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea?
The molecular weight of 1-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea is 354.12 g/mol.
Where can I buy 1-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea?
You can request a quote for 1-[(1,2-Dimethylindol-5-yl)methyl]-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-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(1,2-Dimethylindol-5-yl)methyl]-3-(4-nitrophenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.