AF57705
38324-83-3 | 2-Oxo-1,2-dihydropyrimidine-5-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AF57705
ChemicalName
2-Oxo-1,2-dihydropyrimidine-5-carboxylic acid
CasNumber
38324-83-3
MolecularFormula
C5H4N2O3
MolecularWeight
140.0969
MdlNumber
MFCD08236864
Smiles
Oc1ncc(cn1)C(=O)O
Complexity
241
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
-1
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CatalogNumber: AF57705
ChemicalName: 2-Oxo-1,2-dihydropyrimidine-5-carboxylic acid
CasNumber: 38324-83-3
MolecularFormula: C5H4N2O3
MolecularWeight: 140.0969
MdlNumber: MFCD08236864
Smiles: Oc1ncc(cn1)C(=O)O
Complexity: 241
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: -1
CatalogNumber:
AF57705
ChemicalName:
2-Oxo-1,2-dihydropyrimidine-5-carboxylic acid
CasNumber:
38324-83-3
MolecularFormula:
C5H4N2O3
MolecularWeight:
140.0969
MdlNumber:
MFCD08236864
Smiles:
Oc1ncc(cn1)C(=O)O
Complexity:
241
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
-1
CatalogNumber: AF57706
ChemicalName: (R)-1-Boc-2-ethyl-piperazine
CasNumber: 393781-70-9
MolecularFormula: C11H22N2O2
MolecularWeight: 214.3046
MdlNumber: MFCD03411920
Smiles: CC[C@@H]1CNCCN1C(=O)OC(C)(C)C
Complexity: 223
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.4
CatalogNumber:
AF57706
ChemicalName:
(R)-1-Boc-2-ethyl-piperazine
CasNumber:
393781-70-9
MolecularFormula:
C11H22N2O2
MolecularWeight:
214.3046
MdlNumber:
MFCD03411920
Smiles:
CC[C@@H]1CNCCN1C(=O)OC(C)(C)C
Complexity:
223
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: N#Cc1ccnc2c1cc[nH]2
Complexity: __
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Smiles:
N#Cc1ccnc2c1cc[nH]2
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RotatableBondCount:
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Smiles: Brc1ccc2n(c1)c(/C=N/N(S(=O)(=O)c1cc(ccc1C)[N+](=O)[O-])C)cn2
Complexity: __
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
Brc1ccc2n(c1)c(/C=N/N(S(=O)(=O)c1cc(ccc1C)[N+](=O)[O-])C)cn2
Complexity:
__
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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