Cyclohexyl (5-amino-1,2-dihydro-3-phenylpyrido(3,4-b)pyrazin-7-yl)carbamate
Basic information
- CAS
87607-30-5- Standard SMILES
Nc1nc(NC(=O)OC2CCCCC2)cc2c1N=C(c1ccccc1)CN2- InChIKey
AFQUMPBZZPCGHV-UHFFFAOYSA-N- Molecular formula
- C20H23N5O2
- Average molar mass
- 365.4 g/mol
- Monoisotopic mass
- 365.18517499
Names & identifiers
- Preferred name
- Cyclohexyl (5-amino-1,2-dihydro-3-phenylpyrido(3,4-b)pyrazin-7-yl)carbamate
- IUPAC
- cyclohexyl N-(5-amino-3-phenyl-1,2-dihydropyrido[3,4-b]pyrazin-7-yl)carbamate
Names & synonyms
87607-30-5Cyclohexyl (5-amino-1,2-dihydro-3-phenylpyrido(3,4-b)pyrazin-7-yl)carbamateCyclohexyl (5-amino-3-phenyl-1,2-dihydropyrido[3,4-b]pyrazin-7-yl)carbamateCarbamic acid, (5-amino-1,2-dihydro-3-phenylpyrido(3,4-b)pyrazin-7-yl)-, cyclohexyl esterCHEMBL80893DTXSID401007693Cyclohexyl hydrogen (5-amino-3-phenyl-1,2-dihydropyrido[3,4-b]pyrazin-7-yl)carbonimidate
Database identifiers
- CAS
87607-30-5- PubChem CID
- 174644
- DTXSID
DTXSID401007693- ChEMBL
CHEMBL80893
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 542
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Compound notes
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