1-(5-benzyl-6-methyl-2-phenylpyrimidin-4-yl)-4-(4-chlorobenzene-1-sulfonyl)-1,4-diazepane
Chemical Structure Depiction of
1-(5-benzyl-6-methyl-2-phenylpyrimidin-4-yl)-4-(4-chlorobenzene-1-sulfonyl)-1,4-diazepane
1-(5-benzyl-6-methyl-2-phenylpyrimidin-4-yl)-4-(4-chlorobenzene-1-sulfonyl)-1,4-diazepane
Compound characteristics
| Compound ID: | V009-3946 |
| Compound Name: | 1-(5-benzyl-6-methyl-2-phenylpyrimidin-4-yl)-4-(4-chlorobenzene-1-sulfonyl)-1,4-diazepane |
| Molecular Weight: | 533.09 |
| Molecular Formula: | C29 H29 Cl N4 O2 S |
| Salt: | not_available |
| Smiles: | Cc1c(Cc2ccccc2)c(nc(c2ccccc2)n1)N1CCCN(CC1)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.3125 |
| logD: | 7.2373 |
| logSw: | -6.5568 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.079 |
| InChI Key: | GORLMYOTBGSUST-UHFFFAOYSA-N |