Basic information
- CAS
83269-05-0- Standard SMILES
CCOC(=O)Nc1cc2c(c(N)n1)N=C(CCc1ccccc1)CN2- InChIKey
VIHLFVOGHVVYKC-UHFFFAOYSA-N- Molecular formula
- C18H21N5O2
- Average molar mass
- 339.4 g/mol
- Monoisotopic mass
- 339.16952493
Names & identifiers
- Preferred name
- Carbamic acid, (5-amino-1,2-dihydro-3-(2-phenylethyl)pyrido(3,4-b)pyrazin-7-yl)-, ethyl ester
- IUPAC
- ethyl N-[5-amino-3-(2-phenylethyl)-1,2-dihydropyrido[3,4-b]pyrazin-7-yl]carbamate
Names & synonyms
83269-05-0Carbamic acid, (5-amino-1,2-dihydro-3-(2-phenylethyl)pyrido(3,4-b)pyrazin-7-yl)-, ethyl esterNSC302060CHEMBL172923SCHEMBL10886991DTXSID90232237NSC 302060NSC-302060Carbamic acid,2-dihydro-3-(2-phenylethyl)pyrido[3,4-b]pyrazin-7-yl]-, ethyl esterethyl [5-amino-3-(2-phenylethyl)-1,2-dihydropyrido[3,4-b]pyrazin-7-yl]carbamate
Database identifiers
- CAS
83269-05-0- PubChem CID
- 100445
- DTXSID
DTXSID90232237- ChEMBL
CHEMBL172923
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 478
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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