AB70056
92855-65-7 | 7-Benzyloxyindole-3-carbaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AB70056
ChemicalName
7-Benzyloxyindole-3-carbaldehyde
CasNumber
92855-65-7
MolecularFormula
C16H13NO2
MolecularWeight
251.2799
MdlNumber
MFCD00055979
Smiles
O=Cc1c[nH]c2c1cccc2OCc1ccccc1
NscNumber
92527
Complexity
301
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
3
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CatalogNumber: AB70056
ChemicalName: 7-Benzyloxyindole-3-carbaldehyde
CasNumber: 92855-65-7
MolecularFormula: C16H13NO2
MolecularWeight: 251.2799
MdlNumber: MFCD00055979
Smiles: O=Cc1c[nH]c2c1cccc2OCc1ccccc1
NscNumber: 92527
Complexity: 301
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 3
CatalogNumber:
AB70056
ChemicalName:
7-Benzyloxyindole-3-carbaldehyde
CasNumber:
92855-65-7
MolecularFormula:
C16H13NO2
MolecularWeight:
251.2799
MdlNumber:
MFCD00055979
Smiles:
O=Cc1c[nH]c2c1cccc2OCc1ccccc1
NscNumber:
92527
Complexity:
301
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
3
CatalogNumber: AB70057
ChemicalName: tert-Butyl 3-bromo-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine-7(8h)-carboxylate
CasNumber: 723286-80-4
MolecularFormula: C10H15BrN4O2
MolecularWeight: 303.15569999999997
MdlNumber: MFCD00025627
Smiles: O=C(N1CCn2c(C1)nnc2Br)OC(C)(C)C
NscNumber: __
Complexity: 307
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 0.9
CatalogNumber:
AB70057
ChemicalName:
tert-Butyl 3-bromo-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine-7(8h)-carboxylate
CasNumber:
723286-80-4
MolecularFormula:
C10H15BrN4O2
MolecularWeight:
303.15569999999997
MdlNumber:
MFCD00025627
Smiles:
O=C(N1CCn2c(C1)nnc2Br)OC(C)(C)C
NscNumber:
__
Complexity:
307
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
0.9
CatalogNumber: AB70058
ChemicalName: tert-Butyl 3-bromo-5,6-dihydroimidazo[1,2-a]pyrazine-7(8H)-carboxylate
CasNumber: 949922-61-6
MolecularFormula: C11H16BrN3O2
MolecularWeight: 302.16763999999995
MdlNumber: MFCD09701262
Smiles: O=C(N1CCn2c(C1)ncc2Br)OC(C)(C)C
NscNumber: __
Complexity: 306
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AB70058
ChemicalName:
tert-Butyl 3-bromo-5,6-dihydroimidazo[1,2-a]pyrazine-7(8H)-carboxylate
CasNumber:
949922-61-6
MolecularFormula:
C11H16BrN3O2
MolecularWeight:
302.16763999999995
MdlNumber:
MFCD09701262
Smiles:
O=C(N1CCn2c(C1)ncc2Br)OC(C)(C)C
NscNumber:
__
Complexity:
306
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
1.5
CatalogNumber: AB70059
ChemicalName: tert-Butyl 5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine-7(8h)-carboxylate
CasNumber: 723286-79-1
MolecularFormula: C10H16N4O2
MolecularWeight: 224.2596
MdlNumber: MFCD10574958
Smiles: O=C(N1CCn2c(C1)nnc2)OC(C)(C)C
NscNumber: __
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: -0.1
CatalogNumber:
AB70059
ChemicalName:
tert-Butyl 5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine-7(8h)-carboxylate
CasNumber:
723286-79-1
MolecularFormula:
C10H16N4O2
MolecularWeight:
224.2596
MdlNumber:
MFCD10574958
Smiles:
O=C(N1CCn2c(C1)nnc2)OC(C)(C)C
NscNumber:
__
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
-0.1