Indothiazinone; 4,5-Dihydro

AlkaPlorer ID: AK077657

Synonym: 3-(4,5-Dihydro-2-thiazolecarbonyl)-1H-indole, (4,5-Dihydro-2-thiazolyl)-1H-indol-3-ylmethanone 

IUPAC Name: 4,5-dihydro-1,3-thiazol-2-yl(1H-indol-3-yl)methanone

Structure

SMILES: O=C(C1=NCCS1)C1=CNC2=CC=CC=C12

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InChI: InChI=1S/C12H10N2OS/c15-11(12-13-5-6-16-12)9-7-14-10-4-2-1-3-8(9)10/h1-4,7,14H,5-6H2

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InChIKey: LLGGGPPKCGFGSG-UHFFFAOYSA-N

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Reference

PubChem CID: 91664809

CAS: 244295-62-3

COCONUT: CNP0018078

Source

Species Genus Family Order Class Phylum Kingdom Domain
None Paracoccus Pseudococcidae Hemiptera Insecta Arthropoda Metazoa Eukaryota

Properties Information

Molecule Weight: 230.29200000000003

TPSA: 45.22

MolLogP: 2.4959000000000007

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information