AG23411
550369-26-1 | 1-(Methylsulfonyl)-1,4-diazepane, HCl
Manufacturer: A2B Chem
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CatalogNumber
AG23411
ChemicalName
1-(Methylsulfonyl)-1,4-diazepane, HCl
CasNumber
550369-26-1
MolecularFormula
C6H14N2O2S
MolecularWeight
178.2526
MdlNumber
MFCD08444716
Smiles
CS(=O)(=O)N1CCNCCC1
Complexity
207
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
-0.8
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CatalogNumber: AG23411
ChemicalName: 1-(Methylsulfonyl)-1,4-diazepane, HCl
CasNumber: 550369-26-1
MolecularFormula: C6H14N2O2S
MolecularWeight: 178.2526
MdlNumber: MFCD08444716
Smiles: CS(=O)(=O)N1CCNCCC1
Complexity: 207
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: -0.8
CatalogNumber:
AG23411
ChemicalName:
1-(Methylsulfonyl)-1,4-diazepane, HCl
CasNumber:
550369-26-1
MolecularFormula:
C6H14N2O2S
MolecularWeight:
178.2526
MdlNumber:
MFCD08444716
Smiles:
CS(=O)(=O)N1CCNCCC1
Complexity:
207
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
-0.8
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MolecularFormula: __
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Smiles: NC(=N)NC(=N)Nc1cc(Cl)ccc1Cl.Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
NC(=N)NC(=N)Nc1cc(Cl)ccc1Cl.Cl
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RotatableBondCount:
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Smiles: CC(=C)COc1ccccc1N
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Smiles:
CC(=C)COc1ccccc1N
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: Clc1ccc(cc1)C1CCCNC1
Complexity: __
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
Clc1ccc(cc1)C1CCCNC1
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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