1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate
TL;DR: 1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate (CAS 438214-77-8) is a chemical compound with molecular formula C18H23NO3S2 and molecular weight 365.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-5-propan-2-ylthiophene-3-carboxylate
Also Known As: 1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate, isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-5-isopropyl-3-thiophenecarboxylate, propan-2-yl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-5-propan-2-ylthiophene-3-carboxylate, propan-2-yl 2-{[(4,5-dimethylthiophen-3-yl)carbonyl]amino}-5-(propan-2-yl)thiophene-3-carboxylate, 1-Methylethyl 2-(((4,5-dimethyl-3-thienyl)carbonyl)amino)-5-(1-methylethyl)-3-thiophenecarboxylate
| Molecular Formula | C18H23NO3S2 |
|---|---|
| Molecular Weight | 365.11 g/mol |
| LogP | 5.36734 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 365.11194 |
| Heavy Atoms | 24 |
| Complexity | 756.4021 |
Chemical Identifiers
| CAS Number | 438214-77-8 |
|---|---|
| SMILES | CC1=C(SC=C1C(=O)NC2=C(C=C(S2)C(C)C)C(=O)OC(C)C)C |
Product Overview
1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate (CAS 438214-77-8), with molecular formula C18H23NO3S2 and molecular weight 365.11 g/mol. IUPAC: propan-2-yl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-5-propan-2-ylthiophene-3-carboxylate.
Chemical Property Profile of 1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate
Property Insights of 1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate
The XLogP value of 5.36734 indicates that 1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, 1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate?
The CAS number of 1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate is 438214-77-8.
What is the molecular formula of 1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate?
The molecular formula of 1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate is C18H23NO3S2.
What is the molecular weight of 1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate?
The molecular weight of 1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate is 365.11 g/mol.
Where can I buy 1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate?
You can request a quote for 1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 1-Methylethyl 2-[[(4,5-dimethyl-3-thienyl)carbonyl]amino]-5-(1-methylethyl)-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.