N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(3-methoxypropyl)cyclopentanecarboxamide
Chemical Structure Depiction of
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(3-methoxypropyl)cyclopentanecarboxamide
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(3-methoxypropyl)cyclopentanecarboxamide
Compound characteristics
| Compound ID: | V009-1131 |
| Compound Name: | N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(3-methoxypropyl)cyclopentanecarboxamide |
| Molecular Weight: | 486.63 |
| Molecular Formula: | C26 H34 N2 O5 S |
| Smiles: | Cc1ccsc1CN(Cc1ccc2c(c1)OCO2)C(CN(CCCOC)C(C1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1543 |
| logD: | 4.1543 |
| logSw: | -4.2023 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.146 |
| InChI Key: | ZYINBINWTMJXRQ-UHFFFAOYSA-N |