AH21619
691363-12-9 | 1-Propyl-1,2,3-benzotriazole-5-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AH21619
ChemicalName
1-Propyl-1,2,3-benzotriazole-5-carboxylic acid
CasNumber
691363-12-9
MolecularFormula
C10H11N3O2
MolecularWeight
205.2132
MdlNumber
MFCD09031745
Smiles
CCCn1nnc2c1ccc(c2)C(=O)O
Complexity
247
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.7
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CatalogNumber: AH21619
ChemicalName: 1-Propyl-1,2,3-benzotriazole-5-carboxylic acid
CasNumber: 691363-12-9
MolecularFormula: C10H11N3O2
MolecularWeight: 205.2132
MdlNumber: MFCD09031745
Smiles: CCCn1nnc2c1ccc(c2)C(=O)O
Complexity: 247
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.7
CatalogNumber:
AH21619
ChemicalName:
1-Propyl-1,2,3-benzotriazole-5-carboxylic acid
CasNumber:
691363-12-9
MolecularFormula:
C10H11N3O2
MolecularWeight:
205.2132
MdlNumber:
MFCD09031745
Smiles:
CCCn1nnc2c1ccc(c2)C(=O)O
Complexity:
247
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1c(N)scc1C(C)C
Complexity: 208
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1c(N)scc1C(C)C
Complexity:
208
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.2
CatalogNumber: AH21623
ChemicalName: N-(2-Chlorophenyl)-1,3-propanesultam
CasNumber: 71703-11-2
MolecularFormula: C9H10ClNO2S
MolecularWeight: 231.6992
MdlNumber: MFCD16316245
Smiles: Clc1ccccc1N1CCCS1(=O)=O
Complexity: 298
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AH21623
ChemicalName:
N-(2-Chlorophenyl)-1,3-propanesultam
CasNumber:
71703-11-2
MolecularFormula:
C9H10ClNO2S
MolecularWeight:
231.6992
MdlNumber:
MFCD16316245
Smiles:
Clc1ccccc1N1CCCS1(=O)=O
Complexity:
298
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
1.8
CatalogNumber: AH21624
ChemicalName: tert-Butyl 2H,3H-pyrrolo[2,3-b]pyridine-1-carboxylate
CasNumber: 679392-21-3
MolecularFormula: C12H16N2O2
MolecularWeight: 220.26763999999991
MdlNumber: MFCD24448824
Smiles: O=C(N1CCc2c1nccc2)OC(C)(C)C
Complexity: 273
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 2
CatalogNumber:
AH21624
ChemicalName:
tert-Butyl 2H,3H-pyrrolo[2,3-b]pyridine-1-carboxylate
CasNumber:
679392-21-3
MolecularFormula:
C12H16N2O2
MolecularWeight:
220.26763999999991
MdlNumber:
MFCD24448824
Smiles:
O=C(N1CCc2c1nccc2)OC(C)(C)C
Complexity:
273
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
2