AB50797
98961-97-8 | Piperazine-1-sulfonic acid dimethylamide
Manufacturer: A2B Chem
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CatalogNumber
AB50797
ChemicalName
Piperazine-1-sulfonic acid dimethylamide
CasNumber
98961-97-8
MolecularFormula
C6H15N3O2S
MolecularWeight
193.2672
MdlNumber
MFCD04972523
Smiles
CN(S(=O)(=O)N1CCNCC1)C
Complexity
226
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
-1.2
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CatalogNumber: AB50797
ChemicalName: Piperazine-1-sulfonic acid dimethylamide
CasNumber: 98961-97-8
MolecularFormula: C6H15N3O2S
MolecularWeight: 193.2672
MdlNumber: MFCD04972523
Smiles: CN(S(=O)(=O)N1CCNCC1)C
Complexity: 226
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: -1.2
CatalogNumber:
AB50797
ChemicalName:
Piperazine-1-sulfonic acid dimethylamide
CasNumber:
98961-97-8
MolecularFormula:
C6H15N3O2S
MolecularWeight:
193.2672
MdlNumber:
MFCD04972523
Smiles:
CN(S(=O)(=O)N1CCNCC1)C
Complexity:
226
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
-1.2
CatalogNumber: AB50798
ChemicalName: 4-amino-1-[(2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2-dihydropyrimidin-2-one
CasNumber: 95058-81-4
MolecularFormula: C9H11F2N3O4
MolecularWeight: 263.1981
MdlNumber: MFCD00869720
Smiles: OC[C@H]1O[C@H](C([C@@H]1O)(F)F)n1ccc(nc1=O)N
Complexity: 426
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 3
RotatableBondCount: 2
Xlogp3: -1.5
CatalogNumber:
AB50798
ChemicalName:
4-amino-1-[(2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2-dihydropyrimidin-2-one
CasNumber:
95058-81-4
MolecularFormula:
C9H11F2N3O4
MolecularWeight:
263.1981
MdlNumber:
MFCD00869720
Smiles:
OC[C@H]1O[C@H](C([C@@H]1O)(F)F)n1ccc(nc1=O)N
Complexity:
426
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
3
RotatableBondCount:
2
Xlogp3:
-1.5
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Smiles: COC(=O)c1ccc(cc1Br)C#N
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Smiles:
COC(=O)c1ccc(cc1Br)C#N
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Smiles: COC(=O)CCl
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Smiles:
COC(=O)CCl
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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