AI29880
1314929-01-5 | 1-Ethanesulfonyl-3-methyl-piperazine
Manufacturer: A2B Chem
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CatalogNumber
AI29880
ChemicalName
1-Ethanesulfonyl-3-methyl-piperazine
CasNumber
1314929-01-5
MolecularFormula
C7H16N2O2S
MolecularWeight
192.2791
MdlNumber
MFCD07369705
Smiles
CCS(=O)(=O)N1CCNC(C1)C
Complexity
232
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
-0.3
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CatalogNumber: AI29880
ChemicalName: 1-Ethanesulfonyl-3-methyl-piperazine
CasNumber: 1314929-01-5
MolecularFormula: C7H16N2O2S
MolecularWeight: 192.2791
MdlNumber: MFCD07369705
Smiles: CCS(=O)(=O)N1CCNC(C1)C
Complexity: 232
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: -0.3
CatalogNumber:
AI29880
ChemicalName:
1-Ethanesulfonyl-3-methyl-piperazine
CasNumber:
1314929-01-5
MolecularFormula:
C7H16N2O2S
MolecularWeight:
192.2791
MdlNumber:
MFCD07369705
Smiles:
CCS(=O)(=O)N1CCNC(C1)C
Complexity:
232
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
-0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1cccc(c1c1ncc[nH]1)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1cccc(c1c1ncc[nH]1)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AI29882
ChemicalName: (3-Methylpiperidin-2-yl)methanol
CasNumber: 1314931-73-1
MolecularFormula: C7H15NO
MolecularWeight: 129.2001
MdlNumber: MFCD19223587
Smiles: OCC1NCCCC1C
Complexity: 85
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 2
Xlogp3: 0.5
CatalogNumber:
AI29882
ChemicalName:
(3-Methylpiperidin-2-yl)methanol
CasNumber:
1314931-73-1
MolecularFormula:
C7H15NO
MolecularWeight:
129.2001
MdlNumber:
MFCD19223587
Smiles:
OCC1NCCCC1C
Complexity:
85
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
2
Xlogp3:
0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1O)c1ncc[nH]1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1O)c1ncc[nH]1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__