AA33440
1199773-40-4 | 4-(4-Bromo-1H-pyrazol-1-yl)-N,N-diethylbenzenesulfonamide
Manufacturer: A2B Chem
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CatalogNumber
AA33440
ChemicalName
4-(4-Bromo-1H-pyrazol-1-yl)-N,N-diethylbenzenesulfonamide
CasNumber
1199773-40-4
MolecularFormula
C13H16BrN3O2S
MolecularWeight
358.254
MdlNumber
MFCD13195727
Smiles
CCN(S(=O)(=O)c1ccc(cc1)n1ncc(c1)Br)CC
Complexity
400
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
4
RotatableBondCount
5
Xlogp3
2.5
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CatalogNumber: AA33440
ChemicalName: 4-(4-Bromo-1H-pyrazol-1-yl)-N,N-diethylbenzenesulfonamide
CasNumber: 1199773-40-4
MolecularFormula: C13H16BrN3O2S
MolecularWeight: 358.254
MdlNumber: MFCD13195727
Smiles: CCN(S(=O)(=O)c1ccc(cc1)n1ncc(c1)Br)CC
Complexity: 400
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
Xlogp3: 2.5
CatalogNumber:
AA33440
ChemicalName:
4-(4-Bromo-1H-pyrazol-1-yl)-N,N-diethylbenzenesulfonamide
CasNumber:
1199773-40-4
MolecularFormula:
C13H16BrN3O2S
MolecularWeight:
358.254
MdlNumber:
MFCD13195727
Smiles:
CCN(S(=O)(=O)c1ccc(cc1)n1ncc(c1)Br)CC
Complexity:
400
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
Xlogp3:
2.5
CatalogNumber: AA33441
ChemicalName: 2-Mercapto-6-trifluoromethylthiazolo[4,5-b]pyridine
CasNumber: 1199773-39-1
MolecularFormula: C7H3F3N2S2
MolecularWeight: 236.2373
MdlNumber: MFCD13195715
Smiles: FC(c1cnc2c(c1)sc(=S)[nH]2)(F)F
Complexity: 256
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 6
RotatableBondCount: __
Xlogp3: 2.4
CatalogNumber:
AA33441
ChemicalName:
2-Mercapto-6-trifluoromethylthiazolo[4,5-b]pyridine
CasNumber:
1199773-39-1
MolecularFormula:
C7H3F3N2S2
MolecularWeight:
236.2373
MdlNumber:
MFCD13195715
Smiles:
FC(c1cnc2c(c1)sc(=S)[nH]2)(F)F
Complexity:
256
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
6
RotatableBondCount:
__
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1CN(CC2(N1)CC2)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CN(CC2(N1)CC2)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(NC1(CC1)CNC(=O)OC(C)(C)C)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(NC1(CC1)CNC(=O)OC(C)(C)C)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__