Urea, 1-neopentyl-3-phenyl-2-thio-
TL;DR: Urea, 1-neopentyl-3-phenyl-2-thio- (CAS 15093-39-7) is a chemical compound with molecular formula C12H18N2S and molecular weight 222.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,2-dimethylpropyl)-3-phenylthiourea
Also Known As: Urea, 1-neopentyl-3-phenyl-2-thio-, 1-(2,2-dimethylpropyl)-3-phenylthiourea, 1-Neopentyl-3-phenylthiourea, N-Neopentyl-N -phenylthiourea, N-Neopentyl-N'-phenylthiourea #
| Molecular Formula | C12H18N2S |
|---|---|
| Molecular Weight | 222.12 g/mol |
| LogP | 3.0191 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.11906 |
| Heavy Atoms | 15 |
| Complexity | 314.14404 |
Chemical Identifiers
| CAS Number | 15093-39-7 |
|---|---|
| SMILES | CC(C)(C)CNC(=S)NC1=CC=CC=C1 |
Product Overview
Urea, 1-neopentyl-3-phenyl-2-thio- (CAS 15093-39-7), with molecular formula C12H18N2S and molecular weight 222.12 g/mol. IUPAC: 1-(2,2-dimethylpropyl)-3-phenylthiourea.
Chemical Property Profile of Urea, 1-neopentyl-3-phenyl-2-thio-
Property Insights of Urea, 1-neopentyl-3-phenyl-2-thio-
The XLogP value of 3.0191 indicates that Urea, 1-neopentyl-3-phenyl-2-thio- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.06 Ų, Urea, 1-neopentyl-3-phenyl-2-thio- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, 1-neopentyl-3-phenyl-2-thio- has 2 hydrogen bond donor(s) and 1 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 Urea, 1-neopentyl-3-phenyl-2-thio-?
The CAS number of Urea, 1-neopentyl-3-phenyl-2-thio- is 15093-39-7.
What is the molecular formula of Urea, 1-neopentyl-3-phenyl-2-thio-?
The molecular formula of Urea, 1-neopentyl-3-phenyl-2-thio- is C12H18N2S.
What is the molecular weight of Urea, 1-neopentyl-3-phenyl-2-thio-?
The molecular weight of Urea, 1-neopentyl-3-phenyl-2-thio- is 222.12 g/mol.
Where can I buy Urea, 1-neopentyl-3-phenyl-2-thio-?
You can request a quote for Urea, 1-neopentyl-3-phenyl-2-thio- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-neopentyl-3-phenyl-2-thio-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-neopentyl-3-phenyl-2-thio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.