RefChem:305017
TL;DR: RefChem:305017 (CAS 50831-97-5) is a chemical compound with molecular formula C19H27ClN4O2S and molecular weight 410.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-1,3-thiazole-5-carboxamide;hydrochloride
Also Known As: 5-Thiazolecarboxamide, 2-ethyl-N-(2-(4-(2-methoxyphenyl)-1-piperazinyl)ethyl)-, hydrochloride, 2-Ethyl-N-(2-(4-(2-methoxyphenyl)-1-piperazinyl)ethyl)-5-thiazolecarboxamide hydrochloride, N-beta-(4'-(o-Methoxyphenyl)-1'-piperazinyl)ethyl-2-ethylthiazol-5-carboxamide hydrochloride, 2-ethyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-1,3-thiazole-5-carboxamide hydrochloride, 2-Ethyl-N-{2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl}-1,3-thiazole-5-carboxamide--hydrogen chloride (1/1)
| Molecular Formula | C19H27ClN4O2S |
|---|---|
| Molecular Weight | 410.15 g/mol |
| LogP | 2.6879 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 410.15433 |
| Heavy Atoms | 27 |
| Complexity | 732.00464 |
Chemical Identifiers
| CAS Number | 50831-97-5 |
|---|---|
| SMILES | CCC1=NC=C(S1)C(=O)NCCN2CCN(CC2)C3=CC=CC=C3OC.Cl |
Product Overview
RefChem:305017 (CAS 50831-97-5), with molecular formula C19H27ClN4O2S and molecular weight 410.15 g/mol. IUPAC: 2-ethyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-1,3-thiazole-5-carboxamide;hydrochloride.
Chemical Property Profile of RefChem:305017
Property Insights of RefChem:305017
The XLogP value of 2.6879 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:305017. With a topological polar surface area (TPSA) of 57.7 Ų, RefChem:305017 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:305017 has 1 hydrogen bond donor(s) and 6 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:305017?
The CAS number of RefChem:305017 is 50831-97-5.
What is the molecular formula of RefChem:305017?
The molecular formula of RefChem:305017 is C19H27ClN4O2S.
What is the molecular weight of RefChem:305017?
The molecular weight of RefChem:305017 is 410.15 g/mol.
Where can I buy RefChem:305017?
You can request a quote for RefChem:305017 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:305017?
Yes, KEHONG BIO provides custom synthesis services for RefChem:305017 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.