1-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea
TL;DR: 1-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea (CAS 294668-87-4) is a chemical compound with molecular formula C13H19N3O3S and molecular weight 297.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(dimethylamino)phenyl]-3-(1,1-dioxothiolan-3-yl)urea
Also Known As: 1-(3-(dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea, 1-[3-(dimethylamino)phenyl]-3-(1,1-dioxothiolan-3-yl)urea, F1068-0969, 1-[3-(dimethylamino)phenyl]-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea, N-[3-(dimethylamino)phenyl][(1,1-dioxothiolan-3-yl)amino]carboxamide
| Molecular Formula | C13H19N3O3S |
|---|---|
| Molecular Weight | 297.11 g/mol |
| LogP | 1.0612 |
| Topological Polar Surface Area | 78.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.11472 |
| Heavy Atoms | 20 |
| Complexity | 598.63385 |
Chemical Identifiers
| CAS Number | 294668-87-4 |
|---|---|
| SMILES | CN(C)C1=CC=CC(=C1)NC(=O)NC2CCS(=O)(=O)C2 |
Product Overview
1-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea (CAS 294668-87-4), with molecular formula C13H19N3O3S and molecular weight 297.11 g/mol. IUPAC: 1-[3-(dimethylamino)phenyl]-3-(1,1-dioxothiolan-3-yl)urea.
Chemical Property Profile of 1-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea
Property Insights of 1-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea
The XLogP value of 1.0612 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea. The TPSA of 78.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea. Following Lipinski's Rule of Five, 1-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea 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-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea?
The CAS number of 1-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea is 294668-87-4.
What is the molecular formula of 1-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea?
The molecular formula of 1-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea is C13H19N3O3S.
What is the molecular weight of 1-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea?
The molecular weight of 1-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea is 297.11 g/mol.
Where can I buy 1-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea?
You can request a quote for 1-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-(Dimethylamino)phenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.