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Structure
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| Relationships |
Total Number of functionally related protein(s) :
211
Total Number of Articles : 293
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| PubChem |
5312122
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| Molecular Formula |
C26H29ClN2O4S |
| SMILES |
CN(C/C=C/C1=CC=C(C=C1)Cl)CC2=CC=CC=C2N(CCO)S(=O)(=O)C3=CC=C(C=C3)OC |
| InChI |
InChI=1S/C26H29ClN2O4S/c1-28(17-5-6-21-9-11-23(27)12-10-21)20-22-7-3-4-8-26(22)29(18-19-30)34(31,32)25-15-13-24(33-2)14-16-25/h3-16,30H,17-20H2,1-2H3/b6-5+ |
| synonyms |
- kn-93
- 139298-40-1
- KN 93
- Methoxybenzene-sulfonamide
- KN93
- (E)-N-(2-(((3-(4-Chlorophenyl)allyl)(methyl)amino)methyl)phenyl)-N-(2-hydroxyethyl)-4-methoxybenzenesulfonamide
- 1188890-40-5
- N-[2-[[[(E)-3-(4-chlorophenyl)prop-2-enyl]-methylamino]methyl]phenyl]-N-(2-hydroxyethyl)-4-methoxybenzenesulfonamide
- 2TW744QBU1
- CHEMBL155333
- Benzenesulfonamide, N-[2-[[[3-(4-chlorophenyl)-2-propen-1-yl]methylamino]methyl]phenyl]-N-(2-hydroxyethyl)-4-methoxy-
- N-(2-(((3-(4-Chlorophenyl)-2-propenyl)methylamino)methyl)phenyl)-N-(2-hydroxyethyl)-4-methoxybenzenesulfonamide
- N-(2-(((3-(4-Chlorophenyl)allyl)(methyl)amino)methyl)phenyl)-N-(2-hydroxyethyl)-4-methoxybenzenesulfonamide
- N-[2-[[[3-(4-chlorophenyl)-2-propenyl]methylamino]methyl]phenyl]-N-(2-hydroxyethyl)-4-methoxybenzenesulfonamide
- BENZENESULFONAMIDE, N-(2-(((3-(4-CHLOROPHENYL)-2-PROPEN-1-YL)METHYLAMINO)METHYL)PHENYL)-N-(2-HYDROXYETHYL)-4-METHOXY-
- N-[2-[[[3-(4-Chlorophenyl)-2-propen-1-yl]methylamino]methyl]phenyl]-N-(2-hydroxyethyl)-4-methoxybenzenesulfonamide;
- 2-(N-(2-Hydroxyethyl)-N-(4-methoxybenzenesulfonyl))amino-N-(4-chlorocinnamyl)-N-methylbenzylamine
- KN-93(free base)
- BiomolKI_000041
- BiomolKI2_000049
- UNII-2TW744QBU1
- BMK1-E5
- Benzenesulfonamide, N-(2-(((3-(4-chlorophenyl)-2-propenyl)methylamino)methyl)phenyl)-N-(2-hydroxyethyl)-4-methoxy-
- GTPL6002
- SCHEMBL1983199
- CHEBI:91460
- LLLQTDSSHZREGW-AATRIKPKSA-N
- BCPP000193
- GLXC-03438
- HMS3229K12
Click to show/hide the synonyms
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| Properties |
| Property |
Value |
| MW |
501.0 g/mol |
| HBD |
1 |
| HBA |
6 |
| Rotatable Bond Count |
11 |
| Exact Mass |
500.1536563 g/mol |
| Monoisotopic Mass |
500.1536563 g/mol |
| Heavy Atom Count |
34 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
713 |
| xlogp |
4.5 |
| Topological Polar Surface Area |
78.5 |
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