7'-amino-2'-{[(4-fluorophenyl)methyl]sulfanyl}-2,4'-dioxo-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
Chemical Structure Depiction of
7'-amino-2'-{[(4-fluorophenyl)methyl]sulfanyl}-2,4'-dioxo-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
7'-amino-2'-{[(4-fluorophenyl)methyl]sulfanyl}-2,4'-dioxo-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
Compound characteristics
Compound ID: | 8017-2198 |
Compound Name: | 7'-amino-2'-{[(4-fluorophenyl)methyl]sulfanyl}-2,4'-dioxo-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile |
Molecular Weight: | 446.46 |
Molecular Formula: | C22 H15 F N6 O2 S |
Smiles: | C(c1ccc(cc1)F)SC1NC(C2=C(NC(=C(C#N)C23C(Nc2ccccc23)=O)N)N=1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.573 |
logD: | 1.5681 |
logSw: | -2.5506 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 5 |
Polar surface area: | 107.756 |
InChI Key: | DAMPWJGWLUOYGR-JOCHJYFZSA-N |