![3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide structure](/static/products/132/1329852-32-5.webp)
3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
TL;DR: 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide (CAS 1329852-32-5) is a chemical compound with molecular formula C20H19N3O4S and molecular weight 397.10962 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-(1H-indol-3-yl)ethyl]-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide
Also Known As: 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide, N-(2-(1H-indol-3-yl)ethyl)-3-(1,1-dioxido-3-oxobenzo[d]isothiazol-2(3H)-yl)propanamide, N-[2-(1H-indol-3-yl)ethyl]-3-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide
Technical Specifications
| Molecular Formula | C20H19N3O4S |
| Molecular Weight | 397.10962 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 108.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 397.10962 Da |
| Heavy Atoms | 28 |
| Complexity | 705.0 |
| SMILES | C1=CC=C2C(=C1)C(=CN2)CCNC(=O)CCN3C(=O)C4=CC=CC=C4S3(=O)=O |
| InChIKey | RPQWNUMXNSPRHN-UHFFFAOYSA-N |
Chemical Property Profile of 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
Property Insights of 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide. Following Lipinski's Rule of Five, 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide?
The CAS number of 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide is 1329852-32-5.
What is the molecular formula of 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide?
The molecular formula of 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide is C20H19N3O4S.
What is the molecular weight of 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide?
The molecular weight of 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide is 397.10962 g/mol.
Where can I buy 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide?
You can request a quote for 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide?
Yes, CoreyChem provides custom synthesis services for 3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.