RefChem:387595
TL;DR: RefChem:387595 (CAS 31652-57-0) is a chemical compound with molecular formula C11H18N4O2S and molecular weight 270.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-3-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)thiourea
Also Known As: Uracil, 1,3-dimethyl-5-(butylthiourea)-, Urea, 1-butyl-3-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)-2-thio-, 1-Butyl-3-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)-2-thiourea, 1-butyl-3-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)thiourea, 1-Butyl-3-(2,4-diketo-1,3-dimethyl-1,2,3,4-tetrahydropyrimidin-6-yl)-2-thiourea
| Molecular Formula | C11H18N4O2S |
|---|---|
| Molecular Weight | 270.12 g/mol |
| LogP | 0.1705 |
| Topological Polar Surface Area | 68.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 270.11505 |
| Heavy Atoms | 18 |
| Complexity | 546.9547 |
Chemical Identifiers
| CAS Number | 31652-57-0 |
|---|---|
| SMILES | CCCCNC(=S)NC1=CC(=O)N(C(=O)N1C)C |
Product Overview
RefChem:387595 (CAS 31652-57-0), with molecular formula C11H18N4O2S and molecular weight 270.12 g/mol. IUPAC: 1-butyl-3-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)thiourea.
Chemical Property Profile of RefChem:387595
Property Insights of RefChem:387595
The XLogP value of 0.1705 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:387595. The TPSA of 68.06 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:387595. Following Lipinski's Rule of Five, RefChem:387595 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:387595?
The CAS number of RefChem:387595 is 31652-57-0.
What is the molecular formula of RefChem:387595?
The molecular formula of RefChem:387595 is C11H18N4O2S.
What is the molecular weight of RefChem:387595?
The molecular weight of RefChem:387595 is 270.12 g/mol.
Where can I buy RefChem:387595?
You can request a quote for RefChem:387595 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:387595?
Yes, KEHONG BIO provides custom synthesis services for RefChem:387595 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.