N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(8-methyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(8-methyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl)sulfanyl]acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(8-methyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C916-0721 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(8-methyl-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 450.56 |
| Molecular Formula: | C24 H26 N4 O3 S |
| Smiles: | CN1CCC2(CC1)N=C(C(=N2)SCC(Nc1ccc2c(c1)OCCO2)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.6788 |
| logD: | -0.81 |
| logSw: | -2.566 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.53 |
| InChI Key: | GEOBOYUORQHIRY-UHFFFAOYSA-N |