AC94740
957198-30-0 | 2-(4-Morpholino)pyrimidine-5-boronic acid pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AC94740
ChemicalName
2-(4-Morpholino)pyrimidine-5-boronic acid pinacol ester
CasNumber
957198-30-0
MolecularFormula
C14H22BN3O3
MolecularWeight
291.1538
MdlNumber
MFCD07368246
Smiles
CC1(C)OB(OC1(C)C)c1cnc(nc1)N1CCOCC1
Complexity
351
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
6
RotatableBondCount
2
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CatalogNumber: AC94740
ChemicalName: 2-(4-Morpholino)pyrimidine-5-boronic acid pinacol ester
CasNumber: 957198-30-0
MolecularFormula: C14H22BN3O3
MolecularWeight: 291.1538
MdlNumber: MFCD07368246
Smiles: CC1(C)OB(OC1(C)C)c1cnc(nc1)N1CCOCC1
Complexity: 351
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 6
RotatableBondCount: 2
CatalogNumber:
AC94740
ChemicalName:
2-(4-Morpholino)pyrimidine-5-boronic acid pinacol ester
CasNumber:
957198-30-0
MolecularFormula:
C14H22BN3O3
MolecularWeight:
291.1538
MdlNumber:
MFCD07368246
Smiles:
CC1(C)OB(OC1(C)C)c1cnc(nc1)N1CCOCC1
Complexity:
351
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
6
RotatableBondCount:
2
CatalogNumber: AC94741
ChemicalName: 7-Bromo-1,2-dihydropyrido[2,3-b]pyrazin-3(4h)-one
CasNumber: 957198-15-1
MolecularFormula: C7H6BrN3O
MolecularWeight: 228.046
MdlNumber: MFCD13180542
Smiles: O=C1CNc2c(N1)ncc(c2)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
AC94741
ChemicalName:
7-Bromo-1,2-dihydropyrido[2,3-b]pyrazin-3(4h)-one
CasNumber:
957198-15-1
MolecularFormula:
C7H6BrN3O
MolecularWeight:
228.046
MdlNumber:
MFCD13180542
Smiles:
O=C1CNc2c(N1)ncc(c2)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: AC94744
ChemicalName: 7-Iodo-3,4-dihydropyrido[2,3-b]pyrazin-2(1h)-one
CasNumber: 957193-64-5
MolecularFormula: C7H6IN3O
MolecularWeight: 275.0465
MdlNumber: MFCD12547673
Smiles: Ic1cc2NC(=O)CNc2nc1
Complexity: 199
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
RotatableBondCount: __
CatalogNumber:
AC94744
ChemicalName:
7-Iodo-3,4-dihydropyrido[2,3-b]pyrazin-2(1h)-one
CasNumber:
957193-64-5
MolecularFormula:
C7H6IN3O
MolecularWeight:
275.0465
MdlNumber:
MFCD12547673
Smiles:
Ic1cc2NC(=O)CNc2nc1
Complexity:
199
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)[C@@H]1CC2=CC(=O)CC[C@@]2(C23[C@@H]1[C@@H]1CC[C@@]([C@@]1(C)C[C@H]3O2)(O)CCC(=O)O[K])C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)[C@@H]1CC2=CC(=O)CC[C@@]2(C23[C@@H]1[C@@H]1CC[C@@]([C@@]1(C)C[C@H]3O2)(O)CCC(=O)O[K])C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__