AD04167
67831-83-8 | 2-(Methylthio)-7H-pyrrolo[2,3-d]pyrimidin-4-ol
Manufacturer: A2B Chem
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CatalogNumber
AD04167
ChemicalName
2-(Methylthio)-7H-pyrrolo[2,3-d]pyrimidin-4-ol
CasNumber
67831-83-8
MolecularFormula
C7H7N3OS
MolecularWeight
181.215
MdlNumber
MFCD02668244
Smiles
CSc1nc(O)c2c(n1)[nH]cc2
Complexity
241
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
0.8
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CatalogNumber: AD04167
ChemicalName: 2-(Methylthio)-7H-pyrrolo[2,3-d]pyrimidin-4-ol
CasNumber: 67831-83-8
MolecularFormula: C7H7N3OS
MolecularWeight: 181.215
MdlNumber: MFCD02668244
Smiles: CSc1nc(O)c2c(n1)[nH]cc2
Complexity: 241
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 0.8
CatalogNumber:
AD04167
ChemicalName:
2-(Methylthio)-7H-pyrrolo[2,3-d]pyrimidin-4-ol
CasNumber:
67831-83-8
MolecularFormula:
C7H7N3OS
MolecularWeight:
181.215
MdlNumber:
MFCD02668244
Smiles:
CSc1nc(O)c2c(n1)[nH]cc2
Complexity:
241
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
0.8
CatalogNumber: __
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Smiles: CCCCOc1cc(N2CCOCC2)c(cc1N)OCCCC
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CCCCOc1cc(N2CCOCC2)c(cc1N)OCCCC
Complexity:
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Smiles: OC(=O)c1cc(Cl)c(cc1O)O
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Smiles:
OC(=O)c1cc(Cl)c(cc1O)O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: CCOc1cc([N+](=O)[O-])c(cc1Cl)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCOc1cc([N+](=O)[O-])c(cc1Cl)C
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
__