2-(4-chlorophenyl)-N-methyl-5H,6H,7H,8H,9H-cyclohepta[d]pyrimidin-5-amine
Structure Info
- Chemspace ID
- CSMB00050320117 (Enamine MADE)
- IUPAC Name
- 2-(4-chlorophenyl)-N-methyl-5H,6H,7H,8H,9H-cyclohepta[d]pyrimidin-5-amine
- Mol formula
- C16H18ClN3
- Mol weight
- 288 Da
- Catalog Number(s)
- BBV-57205902, CSC050320117
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.77
- Heavy atoms count
- 20
- Rotatable bond count
- 2
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.375
- Polar surface area (Å)
- 38
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00050320117
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