AB08080
198479-63-9 | 5-(Benzyloxy)-2-(4-(benzyloxy)phenyl)-3-methyl-1H-indole
Manufacturer: A2B Chem
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CatalogNumber
AB08080
ChemicalName
5-(Benzyloxy)-2-(4-(benzyloxy)phenyl)-3-methyl-1H-indole
CasNumber
198479-63-9
MolecularFormula
C29H25NO2
MolecularWeight
419.5143
MdlNumber
MFCD04004106
Smiles
Cc1c([nH]c2c1cc(OCc1ccccc1)cc2)c1ccc(cc1)OCc1ccccc1
Complexity
547
Covalently-bondedUnitCount
1
HeavyAtomCount
32
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
7
Xlogp3
7
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CatalogNumber: AB08080
ChemicalName: 5-(Benzyloxy)-2-(4-(benzyloxy)phenyl)-3-methyl-1H-indole
CasNumber: 198479-63-9
MolecularFormula: C29H25NO2
MolecularWeight: 419.5143
MdlNumber: MFCD04004106
Smiles: Cc1c([nH]c2c1cc(OCc1ccccc1)cc2)c1ccc(cc1)OCc1ccccc1
Complexity: 547
Covalently-bondedUnitCount: 1
HeavyAtomCount: 32
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 7
Xlogp3: 7
CatalogNumber:
AB08080
ChemicalName:
5-(Benzyloxy)-2-(4-(benzyloxy)phenyl)-3-methyl-1H-indole
CasNumber:
198479-63-9
MolecularFormula:
C29H25NO2
MolecularWeight:
419.5143
MdlNumber:
MFCD04004106
Smiles:
Cc1c([nH]c2c1cc(OCc1ccccc1)cc2)c1ccc(cc1)OCc1ccccc1
Complexity:
547
Covalently-bondedUnitCount:
1
HeavyAtomCount:
32
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
7
Xlogp3:
7
CatalogNumber: AB08082
ChemicalName: 5'-Bromo-2'-fluoroacetophenone
CasNumber: 198477-89-3
MolecularFormula: C8H6BrFO
MolecularWeight: 217.035
MdlNumber: MFCD11226880
Smiles: Brc1ccc(c(c1)C(=O)C)F
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 2.4
CatalogNumber:
AB08082
ChemicalName:
5'-Bromo-2'-fluoroacetophenone
CasNumber:
198477-89-3
MolecularFormula:
C8H6BrFO
MolecularWeight:
217.035
MdlNumber:
MFCD11226880
Smiles:
Brc1ccc(c(c1)C(=O)C)F
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
2.4
CatalogNumber: AB08083
ChemicalName: Boc-L-3,4-difluorophenylalanine
CasNumber: 198474-90-7
MolecularFormula: C14H17F2NO4
MolecularWeight: 301.2859
MdlNumber: MFCD00672518
Smiles: O=C(OC(C)(C)C)N[C@H](C(=O)O)Cc1ccc(c(c1)F)F
Complexity: 384
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 6
Xlogp3: 2.7
CatalogNumber:
AB08083
ChemicalName:
Boc-L-3,4-difluorophenylalanine
CasNumber:
198474-90-7
MolecularFormula:
C14H17F2NO4
MolecularWeight:
301.2859
MdlNumber:
MFCD00672518
Smiles:
O=C(OC(C)(C)C)N[C@H](C(=O)O)Cc1ccc(c(c1)F)F
Complexity:
384
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
6
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1CCC(CC1)NC1CCCCC1.O=C(OC(C)(C)C)N[C@@H](C(SCc1ccc(cc1)C)(C)C)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1CCC(CC1)NC1CCCCC1.O=C(OC(C)(C)C)N[C@@H](C(SCc1ccc(cc1)C)(C)C)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__