(S)-tert-butyl 2-(4-(2-amino-5-methyl-1H-imidazol-1-yl)phenyl)-4-(3-methylmorpholino)-5,6-dihydropyrido[3,4-d]pyrimidine-7(8H)-carboxylate
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Basic information
- Standard SMILES
Cc1cnc(N)n1-c1ccc(-c2nc3c(c(N4CCOC[C@@H]4C)n2)CCN(C(=O)OC(C)(C)C)C3)cc1- InChIKey
XEICHIHMRNRHCS-SFHVURJKSA-N- Molecular formula
- C27H35N7O3
- Average molar mass
- 505.6 g/mol
Names & identifiers
- Preferred name
- (S)-tert-butyl 2-(4-(2-amino-5-methyl-1H-imidazol-1-yl)phenyl)-4-(3-methylmorpholino)-5,6-dihydropyrido[3,4-d]pyrimidine-7(8H)-carboxylate
- IUPAC
- tert-butyl 2-[4-(2-amino-5-methylimidazol-1-yl)phenyl]-4-[(3S)-3-methylmorpholin-4-yl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine-7-carboxylate
Names & synonyms
SCHEMBL1837137XEICHIHMRNRHCS-SFHVURJKSA-N(S)-tert-butyl 2-(4-(2-amino-5-methyl-1H-imidazol-1-yl)phenyl)-4-(3-methylmorpholino)-5,6-dihydropyrido[3,4-d]pyrimidine-7(8H)-carboxylate
Database identifiers
- PubChem CID
- 59239461
Properties
Computed structural propertiesFilling in
- XLogP
- 2.9
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 786
Related reactions
1 records
Compound notes
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