Basic information
- Standard SMILES
Nc1nc(N)c2c(ccc3c2ccn3Cc2ccc(Cl)cc2Cl)n1- InChIKey
VYMWMBWBOOAMSN-UHFFFAOYSA-N- Molecular formula
- C17H13Cl2N5
- Average molar mass
- 358.2 g/mol
- Monoisotopic mass
- 357.0548008
Names & identifiers
- Preferred name
- 7-[(2,4-Dichlorophenyl)methyl]pyrrolo[3,2-f]quinazoline-1,3-diamine
- IUPAC
- 7-[(2,4-dichlorophenyl)methyl]pyrrolo[3,2-f]quinazoline-1,3-diamine
Names & synonyms
SCHEMBL11466028VYMWMBWBOOAMSN-UHFFFAOYSA-N7-[(2,4-dichlorophenyl)methyl]pyrrolo[3,2-f]quinazoline-1,3-diamineRI 18-57713-[(2,4-Dichlorophenyl)methyl]pyrrolo[3,2-f]quinazoline-7,9-diamine7-[(2,4-Dichlorophenyl)methyl]-7H-pyrrolo[3,2-f]quinazoline-1,3-diamine
Database identifiers
- PubChem CID
- 485850
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 82.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 453
Related reactions
2 records
Compound notes
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