1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone
TL;DR: 1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone (CAS 380165-80-0) is a chemical compound with molecular formula C12H13N5OS and molecular weight 275.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone
Also Known As: BAS 09537966, 1-(2,3-dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone, 1-(2,3-dihydro-1H-indol-1-yl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanone, 1-(2,3-Dihydro-indol-1-yl)-2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethanone
| Molecular Formula | C12H13N5OS |
|---|---|
| Molecular Weight | 275.08 g/mol |
| LogP | 0.8915 |
| Topological Polar Surface Area | 63.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 275.08408 |
| Heavy Atoms | 19 |
| Complexity | 611.6721 |
Chemical Identifiers
| CAS Number | 380165-80-0 |
|---|---|
| SMILES | CN1C(=NN=N1)SCC(=O)N2CCC3=CC=CC=C32 |
Product Overview
1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone (CAS 380165-80-0), with molecular formula C12H13N5OS and molecular weight 275.08 g/mol. IUPAC: 1-(2,3-dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone.
Chemical Property Profile of 1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone
Property Insights of 1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone
The XLogP value of 0.8915 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone. The TPSA of 63.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone. Following Lipinski's Rule of Five, 1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone has 0 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 1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone?
The CAS number of 1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone is 380165-80-0.
What is the molecular formula of 1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone?
The molecular formula of 1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone is C12H13N5OS.
What is the molecular weight of 1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone?
The molecular weight of 1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone is 275.08 g/mol.
Where can I buy 1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone?
You can request a quote for 1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,3-Dihydroindol-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.