AA44354
128781-80-6 | Boc-3,5-diiodo-tyr-ome
Manufacturer: A2B Chem
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CatalogNumber
AA44354
ChemicalName
Boc-3,5-diiodo-tyr-ome
CasNumber
128781-80-6
MolecularFormula
C15H19I2NO5
MolecularWeight
547.124
MdlNumber
MFCD00237523
Smiles
COC(=O)[C@H](Cc1cc(I)c(c(c1)I)O)NC(=O)OC(C)(C)C
Complexity
415
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
7
Xlogp3
3.8
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CatalogNumber: AA44354
ChemicalName: Boc-3,5-diiodo-tyr-ome
CasNumber: 128781-80-6
MolecularFormula: C15H19I2NO5
MolecularWeight: 547.124
MdlNumber: MFCD00237523
Smiles: COC(=O)[C@H](Cc1cc(I)c(c(c1)I)O)NC(=O)OC(C)(C)C
Complexity: 415
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 3.8
CatalogNumber:
AA44354
ChemicalName:
Boc-3,5-diiodo-tyr-ome
CasNumber:
128781-80-6
MolecularFormula:
C15H19I2NO5
MolecularWeight:
547.124
MdlNumber:
MFCD00237523
Smiles:
COC(=O)[C@H](Cc1cc(I)c(c(c1)I)O)NC(=O)OC(C)(C)C
Complexity:
415
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
3.8
CatalogNumber: AA44355
ChemicalName: 5,6,7-Trimethoxy-1h-indole-2-carboxylic acid
CasNumber: 128781-07-7
MolecularFormula: C12H13NO5
MolecularWeight: 251.23531999999997
MdlNumber: MFCD02664478
Smiles: COc1cc2cc([nH]c2c(c1OC)OC)C(=O)O
Complexity: 311
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 1.8
CatalogNumber:
AA44355
ChemicalName:
5,6,7-Trimethoxy-1h-indole-2-carboxylic acid
CasNumber:
128781-07-7
MolecularFormula:
C12H13NO5
MolecularWeight:
251.23531999999997
MdlNumber:
MFCD02664478
Smiles:
COc1cc2cc([nH]c2c(c1OC)OC)C(=O)O
Complexity:
311
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
1.8
CatalogNumber: AA44359
ChemicalName: Boc-d-4,4'-biphenylalanine
CasNumber: 128779-47-5
MolecularFormula: C20H23NO4
MolecularWeight: 341.4009
MdlNumber: MFCD00191185
Smiles: OC(=O)[C@@H](Cc1ccc(cc1)c1ccccc1)NC(=O)OC(C)(C)C
Complexity: 443
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 3.4
CatalogNumber:
AA44359
ChemicalName:
Boc-d-4,4'-biphenylalanine
CasNumber:
128779-47-5
MolecularFormula:
C20H23NO4
MolecularWeight:
341.4009
MdlNumber:
MFCD00191185
Smiles:
OC(=O)[C@@H](Cc1ccc(cc1)c1ccccc1)NC(=O)OC(C)(C)C
Complexity:
443
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)C1(Cl)SC=C(C1=O)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)C1(Cl)SC=C(C1=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__