Basic information
- Standard SMILES
Cc1cc2c(cn1)OCc1nc(NC(=O)n3ccnc3)sc1-2- InChIKey
CBASNHRUDSLJCA-UHFFFAOYSA-N- Molecular formula
- C14H11N5O2S
- Average molar mass
- 313.34 g/mol
Names & identifiers
- Preferred name
- Imidazole-1-carboxylic acid (8-methyl-4H-5-oxa-1-thia-3,7-diaza-cyclopenta[a]naphthalen-2-yl)-amide
- IUPAC
- N-(12-methyl-8-oxa-3-thia-5,11-diazatricyclo[7.4.0.02,6]trideca-1(9),2(6),4,10,12-pentaen-4-yl)imidazole-1-carboxamide
Names & synonyms
SCHEMBL1078694CBASNHRUDSLJCA-UHFFFAOYSA-NImidazole-1-carboxylic acid (8-methyl-4H-5-oxa-1-thia-3,7-diaza-cyclopenta[a]naphthalen-2-yl)-amide
Database identifiers
- PubChem CID
- 86649533
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 439
Related reactions
2 records
Compound notes
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