Basic information
- Standard SMILES
CSc1nc(-c2cc(C(=O)NCC3CC3)ccc2C)c2ccc(=O)n(-c3c(F)cccc3F)c2n1- InChIKey
WDTNTHDJJJFTHX-UHFFFAOYSA-N- Molecular formula
- C26H22F2N4O2S
- Average molar mass
- 492.5 g/mol
Names & identifiers
- Preferred name
- N-(cyclopropylmethyl)-3-[8-(2,6-difluorophenyl)-2-(methylthio)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-4-methylbenzamide
- IUPAC
- N-(cyclopropylmethyl)-3-[8-(2,6-difluorophenyl)-2-methylsulfanyl-7-oxopyrido[2,3-d]pyrimidin-4-yl]-4-methylbenzamide
Names & synonyms
SCHEMBL2720144WDTNTHDJJJFTHX-UHFFFAOYSA-NN-(cyclopropylmethyl)-3-[8-(2,6-difluorophenyl)-2-(methylthio)-7-oxo-7,8-dihydropyrido[2,3-d]pyrimidin-4-yl]-4-methylbenzamide
Database identifiers
- PubChem CID
- 57434552
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 817
Related reactions
4 records
Linked notes
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