N-{2-[(2-methoxyethyl)amino]-2-oxoethyl}-N-methyl-3-[(phenylmethanesulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-{2-[(2-methoxyethyl)amino]-2-oxoethyl}-N-methyl-3-[(phenylmethanesulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
N-{2-[(2-methoxyethyl)amino]-2-oxoethyl}-N-methyl-3-[(phenylmethanesulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0464 |
| Compound Name: | N-{2-[(2-methoxyethyl)amino]-2-oxoethyl}-N-methyl-3-[(phenylmethanesulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 617.64 |
| Molecular Formula: | C24 H33 N5 O5 S |
| Salt: | CF3COOH |
| Smiles: | CN(CC(NCCOC)=O)C(c1ccc(c(c1)NS(Cc1ccccc1)(=O)=O)N1CCNCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3075 |
| logD: | 0.3075 |
| logSw: | -2.5478 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 106.007 |
| InChI Key: | HBSFRIDHISLVOI-UHFFFAOYSA-N |