4-[6-(cyclopentyloxycarbonyl)aminoindazol-1-ylmethyl]-3-methoxybenzoic N,N-diphenylcarbamic anhydride
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Basic information
- Standard SMILES
COc1cc(C(=O)OC(=O)N(c2ccccc2)c2ccccc2)ccc1Cn1ncc2ccc(NC(=O)OC3CCCC3)cc21- InChIKey
VFQBGRYOAPVYTE-UHFFFAOYSA-N- Molecular formula
- C35H32N4O6
- Average molar mass
- 604.7 g/mol
- Monoisotopic mass
- 604.23218475
Names & identifiers
- Preferred name
- 4-[6-(cyclopentyloxycarbonyl)aminoindazol-1-ylmethyl]-3-methoxybenzoic N,N-diphenylcarbamic anhydride
- IUPAC
- diphenylcarbamoyl 4-[[6-(cyclopentyloxycarbonylamino)indazol-1-yl]methyl]-3-methoxybenzoate
Names & synonyms
SCHEMBL8998206VFQBGRYOAPVYTE-UHFFFAOYSA-N4-[6-(cyclopentyloxycarbonyl)aminoindazol-1-ylmethyl]-3-methoxybenzoic N,N-diphenylcarbamic anhydride
Database identifiers
- PubChem CID
- 88397244
Properties
Computed structural propertiesFilling in
- XLogP
- 6.7
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 45
- Formal charge
- 0
- Complexity
- 977
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Related reactions
1 records
Compound notes
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