AE25232
1052089-49-2 | 1-[4-(Aminomethyl)phenyl]-n-isopropylmethanesulfonamide, HCl
Manufacturer: A2B Chem
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CatalogNumber
AE25232
ChemicalName
1-[4-(Aminomethyl)phenyl]-n-isopropylmethanesulfonamide, HCl
CasNumber
1052089-49-2
MolecularFormula
C11H19ClN2O2S
MolecularWeight
278.7988
MdlNumber
MFCD08245263
Smiles
NCc1ccc(cc1)CS(=O)(=O)NC(C)C.Cl
Complexity
288
Covalently-bondedUnitCount
2
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
5
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CatalogNumber: AE25232
ChemicalName: 1-[4-(Aminomethyl)phenyl]-n-isopropylmethanesulfonamide, HCl
CasNumber: 1052089-49-2
MolecularFormula: C11H19ClN2O2S
MolecularWeight: 278.7988
MdlNumber: MFCD08245263
Smiles: NCc1ccc(cc1)CS(=O)(=O)NC(C)C.Cl
Complexity: 288
Covalently-bondedUnitCount: 2
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 5
CatalogNumber:
AE25232
ChemicalName:
1-[4-(Aminomethyl)phenyl]-n-isopropylmethanesulfonamide, HCl
CasNumber:
1052089-49-2
MolecularFormula:
C11H19ClN2O2S
MolecularWeight:
278.7988
MdlNumber:
MFCD08245263
Smiles:
NCc1ccc(cc1)CS(=O)(=O)NC(C)C.Cl
Complexity:
288
Covalently-bondedUnitCount:
2
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1ccc(cc1)Oc1ccc(cc1)B(O)O
Complexity: 224
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1ccc(cc1)Oc1ccc(cc1)B(O)O
Complexity:
224
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AE25234
ChemicalName: 3-(3-Aminophenyl)benzonitrile, HCl
CasNumber: 1049744-24-2
MolecularFormula: C13H11ClN2
MolecularWeight: 230.6928
MdlNumber: MFCD06656006
Smiles: N#Cc1cccc(c1)c1cccc(c1)N.Cl
Complexity: 253
Covalently-bondedUnitCount: 2
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
CatalogNumber:
AE25234
ChemicalName:
3-(3-Aminophenyl)benzonitrile, HCl
CasNumber:
1049744-24-2
MolecularFormula:
C13H11ClN2
MolecularWeight:
230.6928
MdlNumber:
MFCD06656006
Smiles:
N#Cc1cccc(c1)c1cccc(c1)N.Cl
Complexity:
253
Covalently-bondedUnitCount:
2
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
CatalogNumber: AE25235
ChemicalName: 2-Amino-5-phenylnicotinic acid
CasNumber: 1196157-56-8
MolecularFormula: C12H10N2O2
MolecularWeight: 214.22
MdlNumber: MFCD13190115
Smiles: OC(=O)c1cc(cnc1N)c1ccccc1
Complexity: 251
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
CatalogNumber:
AE25235
ChemicalName:
2-Amino-5-phenylnicotinic acid
CasNumber:
1196157-56-8
MolecularFormula:
C12H10N2O2
MolecularWeight:
214.22
MdlNumber:
MFCD13190115
Smiles:
OC(=O)c1cc(cnc1N)c1ccccc1
Complexity:
251
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2