AF29686
22246-71-5 | 8-Methoxy-2,3,4,5-tetrahydro-benzo[c]azepin-1-one
Manufacturer: A2B Chem
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CatalogNumber
AF29686
ChemicalName
8-Methoxy-2,3,4,5-tetrahydro-benzo[c]azepin-1-one
CasNumber
22246-71-5
MolecularFormula
C11H13NO2
MolecularWeight
191.2264
MdlNumber
MFCD02063284
Smiles
COc1ccc2c(c1)C(=O)NCCC2
Complexity
217
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.6
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CatalogNumber: AF29686
ChemicalName: 8-Methoxy-2,3,4,5-tetrahydro-benzo[c]azepin-1-one
CasNumber: 22246-71-5
MolecularFormula: C11H13NO2
MolecularWeight: 191.2264
MdlNumber: MFCD02063284
Smiles: COc1ccc2c(c1)C(=O)NCCC2
Complexity: 217
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.6
CatalogNumber:
AF29686
ChemicalName:
8-Methoxy-2,3,4,5-tetrahydro-benzo[c]azepin-1-one
CasNumber:
22246-71-5
MolecularFormula:
C11H13NO2
MolecularWeight:
191.2264
MdlNumber:
MFCD02063284
Smiles:
COc1ccc2c(c1)C(=O)NCCC2
Complexity:
217
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.6
CatalogNumber: AF29687
ChemicalName: 5-Bromo-2-phenoxypyrimidine
CasNumber: 257280-25-4
MolecularFormula: C10H7BrN2O
MolecularWeight: 251.0794
MdlNumber: MFCD03646346
Smiles: Brc1cnc(nc1)Oc1ccccc1
Complexity: 166
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 2.8
CatalogNumber:
AF29687
ChemicalName:
5-Bromo-2-phenoxypyrimidine
CasNumber:
257280-25-4
MolecularFormula:
C10H7BrN2O
MolecularWeight:
251.0794
MdlNumber:
MFCD03646346
Smiles:
Brc1cnc(nc1)Oc1ccccc1
Complexity:
166
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCC1CCNCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCC1CCNCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1OC2CC1NC2
Complexity: 84.1
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: -0.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1OC2CC1NC2
Complexity:
84.1
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
-0.3