AI51771
5246-57-1 | M-Beta-hydroxyethylsulfonyl aniline
Manufacturer: A2B Chem
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CatalogNumber
AI51771
ChemicalName
M-Beta-hydroxyethylsulfonyl aniline
CasNumber
5246-57-1
MolecularFormula
C8H11NO3S
MolecularWeight
201.2428
MdlNumber
MFCD00044070
Smiles
OCCS(=O)(=O)c1cccc(c1)N
Complexity
245
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
-0.4
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CatalogNumber: AI51771
ChemicalName: M-Beta-hydroxyethylsulfonyl aniline
CasNumber: 5246-57-1
MolecularFormula: C8H11NO3S
MolecularWeight: 201.2428
MdlNumber: MFCD00044070
Smiles: OCCS(=O)(=O)c1cccc(c1)N
Complexity: 245
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: -0.4
CatalogNumber:
AI51771
ChemicalName:
M-Beta-hydroxyethylsulfonyl aniline
CasNumber:
5246-57-1
MolecularFormula:
C8H11NO3S
MolecularWeight:
201.2428
MdlNumber:
MFCD00044070
Smiles:
OCCS(=O)(=O)c1cccc(c1)N
Complexity:
245
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
-0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1CNC(C1)c1cc2c(s1)cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1CNC(C1)c1cc2c(s1)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI51773
ChemicalName: 1-Methyl-4-(2-pyrrolidinyl)piperidine
CasNumber: 524674-26-8
MolecularFormula: C10H20N2
MolecularWeight: 168.2792
MdlNumber: MFCD05189286
Smiles: CN1CCC(CC1)C1CCCN1
Complexity: 139
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.1
CatalogNumber:
AI51773
ChemicalName:
1-Methyl-4-(2-pyrrolidinyl)piperidine
CasNumber:
524674-26-8
MolecularFormula:
C10H20N2
MolecularWeight:
168.2792
MdlNumber:
MFCD05189286
Smiles:
CN1CCC(CC1)C1CCCN1
Complexity:
139
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CN1CCCC(C1)C1CCCN1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CN1CCCC(C1)C1CCCN1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__