7-butyl-5-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
7-butyl-5-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
7-butyl-5-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | G786-1780 |
| Compound Name: | 7-butyl-5-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 439.54 |
| Molecular Formula: | C22 H25 N5 O3 S |
| Smiles: | CCCCc1nc2c(C(N(C)C(N2C)=O)=O)c(n1)SCC(N1CCc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9643 |
| logD: | 3.9643 |
| logSw: | -4.0672 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.469 |
| InChI Key: | RCGARFNLPIYFJM-UHFFFAOYSA-N |