AB38375
296262-16-3 | (5,6-Dimethyl-thieno[2,3-d]pyrimidin-4-ylsulfanyl)-acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AB38375
ChemicalName
(5,6-Dimethyl-thieno[2,3-d]pyrimidin-4-ylsulfanyl)-acetic acid
CasNumber
296262-16-3
MolecularFormula
C10H10N2O2S2
MolecularWeight
254.3286
MdlNumber
MFCD00449576
Smiles
Cc1c(C)sc2c1c(SCC(=O)O)ncn2
Complexity
278
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.8
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CatalogNumber: AB38375
ChemicalName: (5,6-Dimethyl-thieno[2,3-d]pyrimidin-4-ylsulfanyl)-acetic acid
CasNumber: 296262-16-3
MolecularFormula: C10H10N2O2S2
MolecularWeight: 254.3286
MdlNumber: MFCD00449576
Smiles: Cc1c(C)sc2c1c(SCC(=O)O)ncn2
Complexity: 278
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.8
CatalogNumber:
AB38375
ChemicalName:
(5,6-Dimethyl-thieno[2,3-d]pyrimidin-4-ylsulfanyl)-acetic acid
CasNumber:
296262-16-3
MolecularFormula:
C10H10N2O2S2
MolecularWeight:
254.3286
MdlNumber:
MFCD00449576
Smiles:
Cc1c(C)sc2c1c(SCC(=O)O)ncn2
Complexity:
278
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.8
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Smiles: O=C(NC(C(=O)O)C(=O)O)OCC1c2ccccc2-c2c1cccc2
Complexity: __
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Smiles:
O=C(NC(C(=O)O)C(=O)O)OCC1c2ccccc2-c2c1cccc2
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Smiles: CC(Cc1onc(c1)C)O
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Smiles:
CC(Cc1onc(c1)C)O
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: CC(=O)N1CCOCCN(CCOCC1)C(=O)C
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HeavyAtomCount: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CC(=O)N1CCOCCN(CCOCC1)C(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__