2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide
TL;DR: 2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide (CAS 731827-30-8) is a chemical compound with molecular formula C13H13ClN2OS and molecular weight 280.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[3-[(4-methylphenyl)methyl]-1,3-thiazol-2-ylidene]acetamide
Also Known As: 2-chloro-N-{3-[(4-methylphenyl)methyl]-2,3-dihydro-1,3-thiazol-2-ylidene}acetamide, 2-chloro-N-[3-[(4-methylphenyl)methyl]-1,3-thiazol-2-ylidene]acetamide, 2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide
| Molecular Formula | C13H13ClN2OS |
|---|---|
| Molecular Weight | 280.04 g/mol |
| LogP | 2.57242 |
| Topological Polar Surface Area | 34.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.0437 |
| Heavy Atoms | 18 |
| Complexity | 597.95386 |
Chemical Identifiers
| CAS Number | 731827-30-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C=CSC2=NC(=O)CCl |
Product Overview
2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide (CAS 731827-30-8), with molecular formula C13H13ClN2OS and molecular weight 280.04 g/mol. IUPAC: 2-chloro-N-[3-[(4-methylphenyl)methyl]-1,3-thiazol-2-ylidene]acetamide.
Chemical Property Profile of 2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide
Property Insights of 2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide
The XLogP value of 2.57242 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide. With a topological polar surface area (TPSA) of 34.36 Ų, 2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide has 0 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 2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide?
The CAS number of 2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide is 731827-30-8.
What is the molecular formula of 2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide?
The molecular formula of 2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide is C13H13ClN2OS.
What is the molecular weight of 2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide?
The molecular weight of 2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide is 280.04 g/mol.
Where can I buy 2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide?
You can request a quote for 2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-[(2Z)-3-(4-methylbenzyl)-1,3-thiazol-2(3H)-ylidene]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.