AB28480
259809-79-5 | tert-Butyl 7,8-dihydro-2-(methylsulfonyl)pyrido[4,3-d]pyrimidine-6(5h)-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB28480
ChemicalName
tert-Butyl 7,8-dihydro-2-(methylsulfonyl)pyrido[4,3-d]pyrimidine-6(5h)-carboxylate
CasNumber
259809-79-5
MolecularFormula
C13H19N3O4S
MolecularWeight
313.3727
MdlNumber
MFCD09839783
Smiles
O=C(N1CCc2c(C1)cnc(n2)S(=O)(=O)C)OC(C)(C)C
Complexity
495
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
6
RotatableBondCount
3
Xlogp3
0.5
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CatalogNumber: AB28480
ChemicalName: tert-Butyl 7,8-dihydro-2-(methylsulfonyl)pyrido[4,3-d]pyrimidine-6(5h)-carboxylate
CasNumber: 259809-79-5
MolecularFormula: C13H19N3O4S
MolecularWeight: 313.3727
MdlNumber: MFCD09839783
Smiles: O=C(N1CCc2c(C1)cnc(n2)S(=O)(=O)C)OC(C)(C)C
Complexity: 495
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 6
RotatableBondCount: 3
Xlogp3: 0.5
CatalogNumber:
AB28480
ChemicalName:
tert-Butyl 7,8-dihydro-2-(methylsulfonyl)pyrido[4,3-d]pyrimidine-6(5h)-carboxylate
CasNumber:
259809-79-5
MolecularFormula:
C13H19N3O4S
MolecularWeight:
313.3727
MdlNumber:
MFCD09839783
Smiles:
O=C(N1CCc2c(C1)cnc(n2)S(=O)(=O)C)OC(C)(C)C
Complexity:
495
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
6
RotatableBondCount:
3
Xlogp3:
0.5
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Smiles: COC(=O)c1nc2c(o1)CN(CC2)C(=O)OC(C)(C)C
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Smiles:
COC(=O)c1nc2c(o1)CN(CC2)C(=O)OC(C)(C)C
Complexity:
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Smiles: O=C(N1CCc2c(C1)ccc(n2)C(=O)O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(N1CCc2c(C1)ccc(n2)C(=O)O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1ccc2c(n1)CCN(C2)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1ccc2c(n1)CCN(C2)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__