RefChem:387381
TL;DR: RefChem:387381 (CAS 31652-56-9) is a chemical compound with molecular formula C11H16N4O2S and molecular weight 268.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-3-(2-methylprop-2-enyl)thiourea
Also Known As: Uracil, 1,3-dimethyl-5-(2-methylallylthiourea)-, Urea, 1-(2-methylallyl)-3-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)-2-thio-, 1-(2,4-Diketo-1,3-dimethyl-1,2,3,4-tetrahydropyrimidin-6-yl)-3-methallyl-2-thiourea, 1-(2-Methylallyl)-3-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)-2-thiourea, 1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-3-(2-methylprop-2-enyl)thiourea
| Molecular Formula | C11H16N4O2S |
|---|---|
| Molecular Weight | 268.10 g/mol |
| LogP | -0.0535 |
| Topological Polar Surface Area | 68.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.0994 |
| Heavy Atoms | 18 |
| Complexity | 600.04126 |
Chemical Identifiers
| CAS Number | 31652-56-9 |
|---|---|
| SMILES | CC(=C)CNC(=S)NC1=CC(=O)N(C(=O)N1C)C |
Product Overview
RefChem:387381 (CAS 31652-56-9), with molecular formula C11H16N4O2S and molecular weight 268.10 g/mol. IUPAC: 1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-3-(2-methylprop-2-enyl)thiourea.
Chemical Property Profile of RefChem:387381
Property Insights of RefChem:387381
The XLogP value of -0.0535 indicates that RefChem:387381 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 68.06 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:387381. Following Lipinski's Rule of Five, RefChem:387381 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 RefChem:387381?
The CAS number of RefChem:387381 is 31652-56-9.
What is the molecular formula of RefChem:387381?
The molecular formula of RefChem:387381 is C11H16N4O2S.
What is the molecular weight of RefChem:387381?
The molecular weight of RefChem:387381 is 268.10 g/mol.
Where can I buy RefChem:387381?
You can request a quote for RefChem:387381 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:387381?
Yes, KEHONG BIO provides custom synthesis services for RefChem:387381 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.