2-[(3-chlorophenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbothioamide
Chemical Structure Depiction of
2-[(3-chlorophenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbothioamide
2-[(3-chlorophenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbothioamide
Compound characteristics
| Compound ID: | C201-0370 |
| Compound Name: | 2-[(3-chlorophenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbothioamide |
| Molecular Weight: | 359.83 |
| Molecular Formula: | C17 H14 Cl N3 O2 S |
| Smiles: | Cc1c2c(C=C(/C(=N/c3cccc(c3)[Cl])O2)C(N)=S)c(CO)cn1 |
| Stereo: | ACHIRAL |
| logP: | 2.449 |
| logD: | 2.449 |
| logSw: | -2.9222 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 61.912 |
| InChI Key: | IOVSZCMTQVMQFC-UHFFFAOYSA-N |