N-(4-chloro-2-methoxy-5-methylphenyl)-2-[5-(4-methylpiperidine-1-sulfonyl)-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydro-3H-indol-3-ylidene]hydrazine-1-carbothioamide
Chemical Structure Depiction of
N-(4-chloro-2-methoxy-5-methylphenyl)-2-[5-(4-methylpiperidine-1-sulfonyl)-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydro-3H-indol-3-ylidene]hydrazine-1-carbothioamide
N-(4-chloro-2-methoxy-5-methylphenyl)-2-[5-(4-methylpiperidine-1-sulfonyl)-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydro-3H-indol-3-ylidene]hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | K784-4804 |
| Compound Name: | N-(4-chloro-2-methoxy-5-methylphenyl)-2-[5-(4-methylpiperidine-1-sulfonyl)-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydro-3H-indol-3-ylidene]hydrazine-1-carbothioamide |
| Molecular Weight: | 576.14 |
| Molecular Formula: | C26 H30 Cl N5 O4 S2 |
| Smiles: | CC1CCN(CC1)S(c1ccc2c(c1)/C(C(N2CC=C)=O)=N/NC(Nc1cc(C)c(cc1OC)[Cl])=S)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9538 |
| logD: | 5.9535 |
| logSw: | -5.9949 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.214 |
| InChI Key: | BRZOWCKTCWTBKY-UHFFFAOYSA-N |