AI40167
1820603-32-4 | Methyl 5-BOC-6-methyl-4-oxo-6H,7H-pyrazolo[1,5-a]pyrazine-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI40167
ChemicalName
Methyl 5-BOC-6-methyl-4-oxo-6H,7H-pyrazolo[1,5-a]pyrazine-2-carboxylate
CasNumber
1820603-32-4
MolecularFormula
C14H19N3O5
MolecularWeight
309.3178
MdlNumber
MFCD28166389
Smiles
COC(=O)c1nn2c(c1)C(=O)N(C(C2)C)C(=O)OC(C)(C)C
Complexity
487
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
6
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
1.5
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CatalogNumber: AI40167
ChemicalName: Methyl 5-BOC-6-methyl-4-oxo-6H,7H-pyrazolo[1,5-a]pyrazine-2-carboxylate
CasNumber: 1820603-32-4
MolecularFormula: C14H19N3O5
MolecularWeight: 309.3178
MdlNumber: MFCD28166389
Smiles: COC(=O)c1nn2c(c1)C(=O)N(C(C2)C)C(=O)OC(C)(C)C
Complexity: 487
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 6
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.5
CatalogNumber:
AI40167
ChemicalName:
Methyl 5-BOC-6-methyl-4-oxo-6H,7H-pyrazolo[1,5-a]pyrazine-2-carboxylate
CasNumber:
1820603-32-4
MolecularFormula:
C14H19N3O5
MolecularWeight:
309.3178
MdlNumber:
MFCD28166389
Smiles:
COC(=O)c1nn2c(c1)C(=O)N(C(C2)C)C(=O)OC(C)(C)C
Complexity:
487
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
6
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.5
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Smiles: COc1ccc(c(c1)C)c1cccc(c1)C(=O)OC
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COc1ccc(c(c1)C)c1cccc(c1)C(=O)OC
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Smiles: COC(=O)c1cc(OC)cc(c1)c1cccc(c1)C
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COC(=O)c1cc(OC)cc(c1)c1cccc(c1)C
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Smiles: COC(=O)c1ccc(cc1F)c1ccccc1C(=O)OC
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
COC(=O)c1ccc(cc1F)c1ccccc1C(=O)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__