N-(3-bromo-4-propoxyphenyl)-2-[(4-methoxyphenyl)imino]-3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxamide--hydrogen bromide (1/1)
Chemical Structure Depiction of
N-(3-bromo-4-propoxyphenyl)-2-[(4-methoxyphenyl)imino]-3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxamide--hydrogen bromide (1/1)
N-(3-bromo-4-propoxyphenyl)-2-[(4-methoxyphenyl)imino]-3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxamide--hydrogen bromide (1/1)
Compound characteristics
Compound ID: | 8014-7201 |
Compound Name: | N-(3-bromo-4-propoxyphenyl)-2-[(4-methoxyphenyl)imino]-3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxamide--hydrogen bromide (1/1) |
Molecular Weight: | 691.44 |
Molecular Formula: | C29 H28 Br N3 O5 S |
Salt: | HBr |
Smiles: | CCCOc1ccc(cc1[Br])NC(C1=CC(N(Cc2ccc(cc2)OC)\C(=N/c2ccc(cc2)OC)S1)=O)=O |
Stereo: | ACHIRAL |
logP: | 6.4566 |
logD: | 6.4227 |
logSw: | -5.609 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.73 |
InChI Key: | RSSBIENBKJYNSM-UUDCSCGESA-N |