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Basic information
- Standard SMILES
CCCn1c(C(=O)N(CC2CC2)CC2CC2)c(CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2nnn(C)n2)c2ccccc21- InChIKey
OQORKEITJAUOJN-UHFFFAOYSA-N- Molecular formula
- C32H35F6N7O
- Average molar mass
- 647.7 g/mol
- Monoisotopic mass
- 647.28072774
Names & identifiers
- Preferred name
- 3-{[(3,5-bis-trifluoromethyl-benzyl)-(2-methyl-2H-tetrazol-5-yl)-amino]-methyl}-1-propyl-1H-indole-2-carboxylic acid bis-cyclopropylmethyl-amide
- IUPAC
- 3-[[[3,5-bis(trifluoromethyl)phenyl]methyl-(2-methyltetrazol-5-yl)amino]methyl]-N,N-bis(cyclopropylmethyl)-1-propylindole-2-carboxamide
Names & synonyms
3-{[(3,5-bis-trifluoromethyl-benzyl)-(2-methyl-2H-tetrazol-5-yl)-amino]-methyl}-1-propyl-1H-indole-2-carboxylic acid bis-cyclopropylmethyl-amideSCHEMBL14602985
Database identifiers
- PubChem CID
- 23729331
Properties
Computed structural propertiesFilling in
- XLogP
- 7.5
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 12
- Heavy atoms
- 46
- Formal charge
- 0
- Complexity
- 1,000
Related reactions
2 records
Compound notes
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