1-Butyryl-3-(3,4-dichlorophenyl)-1-methylurea
TL;DR: 1-Butyryl-3-(3,4-dichlorophenyl)-1-methylurea (CAS 115956-49-5) is a chemical compound with molecular formula C12H14Cl2N2O2 and molecular weight 288.04324 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(3,4-dichlorophenyl)carbamoyl]-N-methylbutanamide
Also Known As: 1-BUTYRYL-3-(3,4-DICHLOROPHENYL)-1-METHYLUREA, 3-butanoyl-1-(3,4-dichlorophenyl)-3-methylurea, N-[(3,4-dichlorophenyl)carbamoyl]-N-methyl-butanamide, N-[(3,4-dichlorophenyl)carbamoyl]-N-methylbutanamide, 661-575-7
Technical Specifications
| Molecular Formula | C12H14Cl2N2O2 |
| Molecular Weight | 288.04324 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.04324 Da |
| Heavy Atoms | 18 |
| Complexity | 312.0 |
| SMILES | CCCC(=O)N(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl |
| InChIKey | LFHJNUCNZQKQJM-UHFFFAOYSA-N |
Chemical Property Profile of 1-Butyryl-3-(3,4-dichlorophenyl)-1-methylurea
Property Insights of 1-Butyryl-3-(3,4-dichlorophenyl)-1-methylurea
The XLogP value of 3.8 indicates that 1-Butyryl-3-(3,4-dichlorophenyl)-1-methylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, 1-Butyryl-3-(3,4-dichlorophenyl)-1-methylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butyryl-3-(3,4-dichlorophenyl)-1-methylurea has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Butyryl-3-(3,4-dichlorophenyl)-1-methylurea?
The CAS number of 1-Butyryl-3-(3,4-dichlorophenyl)-1-methylurea is 115956-49-5.
What is the molecular formula of 1-Butyryl-3-(3,4-dichlorophenyl)-1-methylurea?
The molecular formula of 1-Butyryl-3-(3,4-dichlorophenyl)-1-methylurea is C12H14Cl2N2O2.
What is the molecular weight of 1-Butyryl-3-(3,4-dichlorophenyl)-1-methylurea?
The molecular weight of 1-Butyryl-3-(3,4-dichlorophenyl)-1-methylurea is 288.04324 g/mol.
Where can I buy 1-Butyryl-3-(3,4-dichlorophenyl)-1-methylurea?
You can request a quote for 1-Butyryl-3-(3,4-dichlorophenyl)-1-methylurea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Butyryl-3-(3,4-dichlorophenyl)-1-methylurea?
Yes, CoreyChem provides custom synthesis services for 1-Butyryl-3-(3,4-dichlorophenyl)-1-methylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.