![N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide structure](/static/products/6743/674350-17-5.webp)
N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide
TL;DR: N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide (CAS 674350-17-5) is a chemical compound with molecular formula C12H14ClN3O2S and molecular weight 299.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide
Also Known As: N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide, N-{3-[(acetylcarbamothioyl)amino]-4-chlorophenyl}propanamide, N-(3-{[(acetylamino)carbonothioyl]amino}-4-chlorophenyl)propanamide
| Molecular Formula | C12H14ClN3O2S |
|---|---|
| Molecular Weight | 299.05 g/mol |
| LogP | 2.5214 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.04953 |
| Heavy Atoms | 19 |
| Complexity | 519.696 |
Chemical Identifiers
| CAS Number | 674350-17-5 |
|---|---|
| SMILES | CCC(=O)NC1=CC(=C(C=C1)Cl)NC(=S)NC(=O)C |
Product Overview
N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide (CAS 674350-17-5), with molecular formula C12H14ClN3O2S and molecular weight 299.05 g/mol. IUPAC: N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide.
Chemical Property Profile of N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide
Property Insights of N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide
The XLogP value of 2.5214 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide. Following Lipinski's Rule of Five, N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide has 3 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 N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide?
The CAS number of N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide is 674350-17-5.
What is the molecular formula of N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide?
The molecular formula of N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide is C12H14ClN3O2S.
What is the molecular weight of N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide?
The molecular weight of N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide is 299.05 g/mol.
Where can I buy N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide?
You can request a quote for N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-(acetylcarbamothioylamino)-4-chlorophenyl]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.