RefChem:284272
6-bromo-3-[5-[2-hydroxy-3-(4-methylanilino)propyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methylquinazolin-4-one
Also Known As: AC1L1ZKV|RefChem:284272|BRN 4339723|AC1Q2790|J385.705K|4(3H)-Quinazolinone, 6-bromo-3-(5-((2-hydroxy-3-((4-methylphenyl)amino)propyl)thio)-1,3,4-thiadiazol-2-yl)-2-methyl-|6-bromo-3-[5-({2-hydroxy-3-[(4-methylphenyl)amino]propyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-2-methylquinazolin-4(3h)-one|6-bromo-3-[5-[2-hydroxy-3-(4-methylanilino)propyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methylquinazolin-4-one|6-Bromo-2-methyl-3-[5-[[3-(4-methylanilino)-2-hydroxypropyl]thio]-1,3,4-thiadiazol-2-yl]quinazolin-4(3H)-one|6-Bromo-3-(5-{[2-hydroxy-3-(4-methylanilino)propyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylquinazolin-4(3H)-one|6-bromo-3-[5-({2-hydroxy-3-[(4-methylphenyl)amino]propyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-2-methyl-3,4-dihydroquinazolin-4-one
| Molecular Formula | C21H20BrN5O2S2 |
|---|---|
| Molecular Weight | 517.0242 g/mol |
| LogP | 4.18 |
| Topological Polar Surface Area | 92.93 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 517.0242 |
| Heavy Atoms | 31 |
| Complexity | 1273.2 |
Chemical Identifiers
| CAS Number | 135575-58-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NCC(CSC2=NN=C(S2)N3C(=NC4=C(C3=O)C=C(C=C4)Br)C)O |
Product Overview
RefChem:284272 (CAS 135575-58-5), with molecular formula C21H20BrN5O2S2 and molecular weight 517.0242 g/mol. IUPAC: 6-bromo-3-[5-[2-hydroxy-3-(4-methylanilino)propyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methylquinazolin-4-one.
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