N-[2-(diethylamino)-2-oxoethyl]-3-[(4-ethylbenzene-1-sulfonyl)amino]-N-methyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[2-(diethylamino)-2-oxoethyl]-3-[(4-ethylbenzene-1-sulfonyl)amino]-N-methyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
N-[2-(diethylamino)-2-oxoethyl]-3-[(4-ethylbenzene-1-sulfonyl)amino]-N-methyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0432 |
| Compound Name: | N-[2-(diethylamino)-2-oxoethyl]-3-[(4-ethylbenzene-1-sulfonyl)amino]-N-methyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 629.7 |
| Molecular Formula: | C26 H37 N5 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCc1ccc(cc1)S(Nc1cc(ccc1N1CCNCC1)C(N(C)CC(N(CC)CC)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2248 |
| logD: | 2.2248 |
| logSw: | -3.0279 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.129 |
| InChI Key: | KXZVFPZKBBMICV-UHFFFAOYSA-N |