![2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate structure](/static/products/7442/744270-01-7.webp)
2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate
TL;DR: 2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate (CAS 744270-01-7) is a chemical compound with molecular formula C22H23N3O4S and molecular weight 425.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 3-(1H-indol-3-yl)propanoate
Also Known As: 2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate, [2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 3-(1H-indol-3-yl)propanoate, 2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl 3-(1H-indol-3-yl)propanoate
| Molecular Formula | C22H23N3O4S |
|---|---|
| Molecular Weight | 425.14 g/mol |
| LogP | 3.3216 |
| Topological Polar Surface Area | 114.28 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 425.14093 |
| Heavy Atoms | 30 |
| Complexity | 1114.9833 |
Chemical Identifiers
| CAS Number | 744270-01-7 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)COC(=O)CCC3=CNC4=CC=CC=C43)C(=O)N |
Product Overview
2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate (CAS 744270-01-7), with molecular formula C22H23N3O4S and molecular weight 425.14 g/mol. IUPAC: [2-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 3-(1H-indol-3-yl)propanoate.
Chemical Property Profile of 2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate
Property Insights of 2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate
The XLogP value of 3.3216 indicates that 2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate. Following Lipinski's Rule of Five, 2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate has 3 hydrogen bond donor(s) and 5 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-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate?
The CAS number of 2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate is 744270-01-7.
What is the molecular formula of 2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate?
The molecular formula of 2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate is C22H23N3O4S.
What is the molecular weight of 2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate?
The molecular weight of 2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate is 425.14 g/mol.
Where can I buy 2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate?
You can request a quote for 2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[[3-(Aminocarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]amino]-2-oxoethyl 1H-indole-3-propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.