N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(3-methoxypropyl)cyclobutanecarboxamide
Chemical Structure Depiction of
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(3-methoxypropyl)cyclobutanecarboxamide
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(3-methoxypropyl)cyclobutanecarboxamide
Compound characteristics
| Compound ID: | V016-3981 |
| Compound Name: | N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-N-(3-methoxypropyl)cyclobutanecarboxamide |
| Molecular Weight: | 472.6 |
| Molecular Formula: | C25 H32 N2 O5 S |
| Smiles: | Cc1ccsc1CN(Cc1ccc2c(c1)OCO2)C(CN(CCCOC)C(C1CCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2462 |
| logD: | 3.2462 |
| logSw: | -3.117 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.111 |
| InChI Key: | LJNWTQUSNHBCEE-UHFFFAOYSA-N |