AB51050
479064-92-1 | Fmoc-(r)-3-amino-3-(4-chlorophenyl)propionic acid
Manufacturer: A2B Chem
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CatalogNumber
AB51050
ChemicalName
Fmoc-(r)-3-amino-3-(4-chlorophenyl)propionic acid
CasNumber
479064-92-1
MolecularFormula
C24H20ClNO4
MolecularWeight
421.8729
MdlNumber
MFCD03428036
Smiles
OC(=O)C[C@H](c1ccc(cc1)Cl)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity
584
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
30
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
7
Xlogp3
4.7
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CatalogNumber: AB51050
ChemicalName: Fmoc-(r)-3-amino-3-(4-chlorophenyl)propionic acid
CasNumber: 479064-92-1
MolecularFormula: C24H20ClNO4
MolecularWeight: 421.8729
MdlNumber: MFCD03428036
Smiles: OC(=O)C[C@H](c1ccc(cc1)Cl)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity: 584
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 30
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 4.7
CatalogNumber:
AB51050
ChemicalName:
Fmoc-(r)-3-amino-3-(4-chlorophenyl)propionic acid
CasNumber:
479064-92-1
MolecularFormula:
C24H20ClNO4
MolecularWeight:
421.8729
MdlNumber:
MFCD03428036
Smiles:
OC(=O)C[C@H](c1ccc(cc1)Cl)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity:
584
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
30
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
4.7
CatalogNumber: AB51051
ChemicalName: 5-Bromo-3-iodo-1H-indazole
CasNumber: 459133-66-5
MolecularFormula: C7H4BrIN2
MolecularWeight: 322.9285
MdlNumber: MFCD07781637
Smiles: Brc1ccc2c(c1)c(I)n[nH]2
Complexity: 155
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 2.9
CatalogNumber:
AB51051
ChemicalName:
5-Bromo-3-iodo-1H-indazole
CasNumber:
459133-66-5
MolecularFormula:
C7H4BrIN2
MolecularWeight:
322.9285
MdlNumber:
MFCD07781637
Smiles:
Brc1ccc2c(c1)c(I)n[nH]2
Complexity:
155
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
2.9
CatalogNumber: AB51052
ChemicalName: (1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione
CasNumber: 458-37-7
MolecularFormula: C21H20O6
MolecularWeight: 368.3799
MdlNumber: MFCD00008365
Smiles: COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(c(c2)OC)O)ccc1O
Complexity: 507
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 27
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 8
Xlogp3: 3.2
CatalogNumber:
AB51052
ChemicalName:
(1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione
CasNumber:
458-37-7
MolecularFormula:
C21H20O6
MolecularWeight:
368.3799
MdlNumber:
MFCD00008365
Smiles:
COc1cc(/C=C/C(=O)CC(=O)/C=C/c2ccc(c(c2)OC)O)ccc1O
Complexity:
507
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
27
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
8
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Sc1ncnc2c1[nH]cn2
Complexity: 190
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Sc1ncnc2c1[nH]cn2
Complexity:
190
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__