6-tert-butyl-4-({3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-tert-butyl-4-({3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl}methyl)-2H-1,4-benzoxazin-3(4H)-one
6-tert-butyl-4-({3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | V006-6051 |
| Compound Name: | 6-tert-butyl-4-({3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl}methyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 513.64 |
| Molecular Formula: | C31 H35 N3 O4 |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1ccc2c(c1)N(Cc1cccc(c1)C(N1CCN(CC1)c1ccccc1OC)=O)C(CO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8349 |
| logD: | 4.8349 |
| logSw: | -4.714 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.306 |
| InChI Key: | ZQPBISCNSWPMBQ-UHFFFAOYSA-N |