AC15933
863028-98-2 | 4-(Methylamino)-2-(methylthio)-5-pyrimidinecarboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AC15933
ChemicalName
4-(Methylamino)-2-(methylthio)-5-pyrimidinecarboxylic acid
CasNumber
863028-98-2
MolecularFormula
C7H9N3O2S
MolecularWeight
199.2303
MdlNumber
MFCD11617313
Smiles
CNc1nc(SC)ncc1C(=O)O
Complexity
191
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
1.4
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CatalogNumber: AC15933
ChemicalName: 4-(Methylamino)-2-(methylthio)-5-pyrimidinecarboxylic acid
CasNumber: 863028-98-2
MolecularFormula: C7H9N3O2S
MolecularWeight: 199.2303
MdlNumber: MFCD11617313
Smiles: CNc1nc(SC)ncc1C(=O)O
Complexity: 191
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 1.4
CatalogNumber:
AC15933
ChemicalName:
4-(Methylamino)-2-(methylthio)-5-pyrimidinecarboxylic acid
CasNumber:
863028-98-2
MolecularFormula:
C7H9N3O2S
MolecularWeight:
199.2303
MdlNumber:
MFCD11617313
Smiles:
CNc1nc(SC)ncc1C(=O)O
Complexity:
191
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1nc([nH]c1I)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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:
[O-][N+](=O)c1nc([nH]c1I)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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CatalogNumber: AC15945
ChemicalName: 3-(4-Amino-phenoxy)-pyrrolidine-1-carboxylic acid tert-butyl ester
CasNumber: 862874-75-7
MolecularFormula: C15H22N2O3
MolecularWeight: 278.3468
MdlNumber: MFCD06658354
Smiles: Nc1ccc(cc1)OC1CCN(C1)C(=O)OC(C)(C)C
Complexity: 333
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 2.3
CatalogNumber:
AC15945
ChemicalName:
3-(4-Amino-phenoxy)-pyrrolidine-1-carboxylic acid tert-butyl ester
CasNumber:
862874-75-7
MolecularFormula:
C15H22N2O3
MolecularWeight:
278.3468
MdlNumber:
MFCD06658354
Smiles:
Nc1ccc(cc1)OC1CCN(C1)C(=O)OC(C)(C)C
Complexity:
333
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1cccc(c1)c1cn2c(n1)nc(cc2)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1cccc(c1)c1cn2c(n1)nc(cc2)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__