AI34968
1422344-37-3 | Ethyl 5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI34968
ChemicalName
Ethyl 5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine-2-carboxylate
CasNumber
1422344-37-3
MolecularFormula
C8H12N4O2
MolecularWeight
196.2065
MdlNumber
MFCD23378343
Smiles
CCOC(=O)c1nn2c(n1)CNCC2
Complexity
223
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
-0.3
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CatalogNumber: AI34968
ChemicalName: Ethyl 5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine-2-carboxylate
CasNumber: 1422344-37-3
MolecularFormula: C8H12N4O2
MolecularWeight: 196.2065
MdlNumber: MFCD23378343
Smiles: CCOC(=O)c1nn2c(n1)CNCC2
Complexity: 223
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: -0.3
CatalogNumber:
AI34968
ChemicalName:
Ethyl 5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine-2-carboxylate
CasNumber:
1422344-37-3
MolecularFormula:
C8H12N4O2
MolecularWeight:
196.2065
MdlNumber:
MFCD23378343
Smiles:
CCOC(=O)c1nn2c(n1)CNCC2
Complexity:
223
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
-0.3
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Smiles: C=CCN1C(=O)CNCC1=O.Cl
Complexity: __
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C=CCN1C(=O)CNCC1=O.Cl
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Smiles: O=C(OC(C)(C)C)NC(c1ncc(cn1)O)(C)C
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Smiles:
O=C(OC(C)(C)C)NC(c1ncc(cn1)O)(C)C
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Smiles: BrCC1OCCc2c1nn(c2)Cc1ccccc1
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Smiles:
BrCC1OCCc2c1nn(c2)Cc1ccccc1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
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