![propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate structure](/static/products/3526/352686-03-4.webp)
propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate
TL;DR: propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate (CAS 352686-03-4) is a chemical compound with molecular formula C20H19ClN2O4S2 and molecular weight 450.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate
Also Known As: propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate, isopropyl 4-(aminocarbonyl)-5-{[(3-chloro-6-methyl-1-benzothien-2-yl)carbonyl]amino}-3-methyl-2-thiophenecarboxylate, ISOPROPYL 4-(AMINOCARBONYL)-5-{[(3-CHLORO-6-METHYL-1-BENZOTHIOPHEN-2-YL)CARBONYL]AMINO}-3-METHYL-2-THIOPHENECARBOXYLATE, propan-2-yl 4-carbamoyl-5-{[(3-chloro-6-methyl-1-benzothiophen-2-yl)carbonyl]amino}-3-methylthiophene-2-carboxylate
| Molecular Formula | C20H19ClN2O4S2 |
|---|---|
| Molecular Weight | 450.05 g/mol |
| LogP | 5.14944 |
| Topological Polar Surface Area | 98.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 450.0475 |
| Heavy Atoms | 29 |
| Complexity | 1147.2538 |
Chemical Identifiers
| CAS Number | 352686-03-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)C(=C(S2)C(=O)NC3=C(C(=C(S3)C(=O)OC(C)C)C)C(=O)N)Cl |
Product Overview
propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate (CAS 352686-03-4), with molecular formula C20H19ClN2O4S2 and molecular weight 450.05 g/mol. IUPAC: propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate.
Chemical Property Profile of propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate
Property Insights of propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate
The XLogP value of 5.14944 indicates that propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.49 Ų falls within the moderate polarity range, balancing permeability and solubility for propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate. Following Lipinski's Rule of Five, propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate?
The CAS number of propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate is 352686-03-4.
What is the molecular formula of propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate?
The molecular formula of propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate is C20H19ClN2O4S2.
What is the molecular weight of propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate?
The molecular weight of propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate is 450.05 g/mol.
Where can I buy propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate?
You can request a quote for propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for propan-2-yl 4-carbamoyl-5-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-3-methylthiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.