2-[[[4-(Cyclopropanecarbonylamino)benzoyl]amino]carbamoyl]cyclohexane-1-carboxylic acid
Basic information
- CAS
1212408-31-5- Standard SMILES
O=C(NNC(=O)C1CCCCC1C(=O)O)c1ccc(NC(=O)C2CC2)cc1- InChIKey
YCEDKBMRXBWBFZ-UHFFFAOYSA-N- Molecular formula
- C19H23N3O5
- Average molar mass
- 373.4 g/mol
Names & identifiers
- Preferred name
- 2-[[[4-(Cyclopropanecarbonylamino)benzoyl]amino]carbamoyl]cyclohexane-1-carboxylic acid
- IUPAC
- 2-[[[4-(cyclopropanecarbonylamino)benzoyl]amino]carbamoyl]cyclohexane-1-carboxylic acid
- English name
- 2-[(2-{4-[(cyclopropylcarbonyl)amino]benzoyl}hydrazino)carbonyl]cyclohexanecarboxylic acid
- Molecular formula
- C19H23N3O5
- Molecular weight
- 373.41
Names & synonyms
2-[(2-{4-[(cyclopropylcarbonyl)amino]benzoyl}hydrazino)carbonyl]cyclohexanecarboxylic acid2-[[[4-(cyclopropanecarbonylamino)benzoyl]amino]carbamoyl]cyclohexane-1-carboxylic acidSCHEMBL28914765913246-40-9
Database identifiers
- CAS
1212408-31-5
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 596
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Compound notes
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