Basic information
- Standard SMILES
CCC(CC)Nc1nc(C)nc(N2CCc3cc(Cl)cc(Cl)c32)c1CO- InChIKey
NZTXNNXODPSPJM-UHFFFAOYSA-N- Molecular formula
- C19H24Cl2N4O
- Average molar mass
- 395.3 g/mol
- Monoisotopic mass
- 394.1327168
Names & identifiers
- Preferred name
- 4-(5,7-dichloro-2,3-dihydro-1H-indol-1-yl)-6-(1-ethylpropylamino)-5-hydroxymethyl-2-methylpyrimidine
- IUPAC
- [4-(5,7-dichloro-2,3-dihydroindol-1-yl)-2-methyl-6-(pentan-3-ylamino)pyrimidin-5-yl]methanol
Names & synonyms
SCHEMBL4870326NZTXNNXODPSPJM-UHFFFAOYSA-N4-(5,7-dichloro-2,3-dihydro-1H-indol-1-yl)-6-(1-ethylpropylamino)-5-hydroxymethyl-2-methylpyrimidine
Database identifiers
- PubChem CID
- 10157504
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 61.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 453
Related reactions
3 records
Compound notes
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