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N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide
TL;DR: N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide (CAS 443290-63-9) is a chemical compound with molecular formula C12H15ClN2OS and molecular weight 270.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide
Also Known As: N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide, N-[[(4-Chlorophenyl)amino]thioxomethyl]-3-methylbutanamide, N-(4-chlorophenyl)-N'-(3-methylbutanoyl)thiourea, N-(4-Chlorophenyl)-N/'-(3-methylbutanoyl)thiourea, 1-(4-CHLOROPHENYL)-3-(3-METHYLBUTANOYL)THIOUREA
| Molecular Formula | C12H15ClN2OS |
|---|---|
| Molecular Weight | 270.06 g/mol |
| LogP | 3.1991 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 270.05936 |
| Heavy Atoms | 17 |
| Complexity | 403.4716 |
Chemical Identifiers
| CAS Number | 443290-63-9 |
|---|---|
| SMILES | CC(C)CC(=O)NC(=S)NC1=CC=C(C=C1)Cl |
Product Overview
N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide (CAS 443290-63-9), with molecular formula C12H15ClN2OS and molecular weight 270.06 g/mol. IUPAC: N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide.
Chemical Property Profile of N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide
Property Insights of N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide
The XLogP value of 3.1991 indicates that N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide has 2 hydrogen bond donor(s) and 2 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 N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide?
The CAS number of N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide is 443290-63-9.
What is the molecular formula of N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide?
The molecular formula of N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide is C12H15ClN2OS.
What is the molecular weight of N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide?
The molecular weight of N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide is 270.06 g/mol.
Where can I buy N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide?
You can request a quote for N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-chlorophenyl)carbamothioyl]-3-methylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.