N-[2-(diethylamino)-2-oxoethyl]-N-methyl-3-[(4-methylbenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[2-(diethylamino)-2-oxoethyl]-N-methyl-3-[(4-methylbenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
N-[2-(diethylamino)-2-oxoethyl]-N-methyl-3-[(4-methylbenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0207 |
| Compound Name: | N-[2-(diethylamino)-2-oxoethyl]-N-methyl-3-[(4-methylbenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 615.67 |
| Molecular Formula: | C25 H35 N5 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCN(CC)C(CN(C)C(c1ccc(c(c1)NS(c1ccc(C)cc1)(=O)=O)N1CCNCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7176 |
| logD: | 1.7176 |
| logSw: | -2.8441 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.129 |
| InChI Key: | BXHOFGFMWXTKMS-UHFFFAOYSA-N |