7'-amino-2'-(ethylsulfanyl)-2,4'-dioxo-1-(prop-2-yn-1-yl)-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'-(ethylsulfanyl)-2,4'-dioxo-1-(prop-2-yn-1-yl)-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
7'-amino-2'-(ethylsulfanyl)-2,4'-dioxo-1-(prop-2-yn-1-yl)-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
Compound characteristics
| Compound ID: | 8017-1923 |
| Compound Name: | 7'-amino-2'-(ethylsulfanyl)-2,4'-dioxo-1-(prop-2-yn-1-yl)-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile |
| Molecular Weight: | 404.45 |
| Molecular Formula: | C20 H16 N6 O2 S |
| Smiles: | CCSC1NC(C2=C(NC(=C(C#N)C23C(N(CC#C)c2ccccc23)=O)N)N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4421 |
| logD: | 1.4334 |
| logSw: | -2.5769 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 98.503 |
| InChI Key: | RLNNAHCXRAMATD-HXUWFJFHSA-N |