AA66176
1477949-42-0 | Santacruzamate A
Manufacturer: A2B Chem
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CatalogNumber
AA66176
ChemicalName
Santacruzamate A
CasNumber
1477949-42-0
MolecularFormula
C15H22N2O3
MolecularWeight
278.3467800000001
MdlNumber
MFCD28348356
Smiles
CCOC(=O)NCCCC(=O)NCCc1ccccc1
Complexity
289
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
9
Xlogp3
1.9
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CatalogNumber: AA66176
ChemicalName: Santacruzamate A
CasNumber: 1477949-42-0
MolecularFormula: C15H22N2O3
MolecularWeight: 278.3467800000001
MdlNumber: MFCD28348356
Smiles: CCOC(=O)NCCCC(=O)NCCc1ccccc1
Complexity: 289
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 9
Xlogp3: 1.9
CatalogNumber:
AA66176
ChemicalName:
Santacruzamate A
CasNumber:
1477949-42-0
MolecularFormula:
C15H22N2O3
MolecularWeight:
278.3467800000001
MdlNumber:
MFCD28348356
Smiles:
CCOC(=O)NCCCC(=O)NCCc1ccccc1
Complexity:
289
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
9
Xlogp3:
1.9
CatalogNumber: AA66177
ChemicalName: 5-Bromo-1,3-difluoro-2-nitrobenzene
CasNumber: 147808-42-2
MolecularFormula: C6H2BrF2NO2
MolecularWeight: 237.98638640000001
MdlNumber: MFCD12025434
Smiles: Fc1cc(Br)cc(c1[N+](=O)[O-])F
Complexity: 175
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.6
CatalogNumber:
AA66177
ChemicalName:
5-Bromo-1,3-difluoro-2-nitrobenzene
CasNumber:
147808-42-2
MolecularFormula:
C6H2BrF2NO2
MolecularWeight:
237.98638640000001
MdlNumber:
MFCD12025434
Smiles:
Fc1cc(Br)cc(c1[N+](=O)[O-])F
Complexity:
175
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1cc(O)cc(c1[N+](=O)[O-])F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1cc(O)cc(c1[N+](=O)[O-])F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1cc(I)cc(c1[N+](=O)[O-])F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1cc(I)cc(c1[N+](=O)[O-])F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__