2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridine-3-carbonitrile
2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8003-6080 |
| Compound Name: | 2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridine-3-carbonitrile |
| Molecular Weight: | 446.42 |
| Molecular Formula: | C21 H17 Cl2 N3 S2 |
| Smiles: | CN1CCc2c(C1)c(c(C#N)c(n2)SCc1ccc(c(c1)[Cl])[Cl])c1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 5.8212 |
| logD: | 5.8202 |
| logSw: | -6.3537 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.3486 |
| InChI Key: | UWKHUZDRQZNKFQ-UHFFFAOYSA-N |