Completing data — usually done within a minute
Basic information
- CAS
661467-90-9- Standard SMILES
NC(=O)c1[nH]c2ccc(Cl)cc2c1S(=O)(=O)N1CCC1- InChIKey
CQIBAQUOQBVTGN-UHFFFAOYSA-N- Molecular formula
- C12H12ClN3O3S
- Average molar mass
- 313.76 g/mol
- Monoisotopic mass
- 313.0287901
Names & identifiers
- Preferred name
- 3-(azetidin-1-ylsulfonyl)-5-chloro-1H-indole-2-carboxamide
- IUPAC
- 3-(azetidin-1-ylsulfonyl)-5-chloro-1H-indole-2-carboxamide
Names & synonyms
661467-90-93-(azetidin-1-ylsulfonyl)-5-chloro-1H-indole-2-carboxamideSCHEMBL2928734DTXSID20435072CQIBAQUOQBVTGN-UHFFFAOYSA-NDA-038153-(AZETIDINE-1-SULFONYL)-5-CHLORO-1H-INDOLE-2-CARBOXAMIDE
Database identifiers
- CAS
661467-90-9- PubChem CID
- 10064201
- DTXSID
DTXSID20435072
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 503
Related reactions
1 records
Compound notes
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