AA70905
144069-67-0 | Boc-L-indoline-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA70905
ChemicalName
Boc-L-indoline-2-carboxylic acid
CasNumber
144069-67-0
MolecularFormula
C14H17NO4
MolecularWeight
263.2891
MdlNumber
MFCD00273433
Smiles
OC(=O)[C@@H]1Cc2c(N1C(=O)OC(C)(C)C)cccc2
Complexity
374
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.3
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CatalogNumber: AA70905
ChemicalName: Boc-L-indoline-2-carboxylic acid
CasNumber: 144069-67-0
MolecularFormula: C14H17NO4
MolecularWeight: 263.2891
MdlNumber: MFCD00273433
Smiles: OC(=O)[C@@H]1Cc2c(N1C(=O)OC(C)(C)C)cccc2
Complexity: 374
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.3
CatalogNumber:
AA70905
ChemicalName:
Boc-L-indoline-2-carboxylic acid
CasNumber:
144069-67-0
MolecularFormula:
C14H17NO4
MolecularWeight:
263.2891
MdlNumber:
MFCD00273433
Smiles:
OC(=O)[C@@H]1Cc2c(N1C(=O)OC(C)(C)C)cccc2
Complexity:
374
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1CCc2c(C1)cc(cc2Br)Br
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CCc2c(C1)cc(cc2Br)Br
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCC1CCCCN1C.Cl.Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCC1CCCCN1C.Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA70923
ChemicalName: N-t-Butyl-2-methoxynicotinamide
CasNumber: 144084-35-5
MolecularFormula: C11H16N2O2
MolecularWeight: 208.2569
MdlNumber: MFCD13195783
Smiles: COc1ncccc1C(=O)NC(C)(C)C
Complexity: 223
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.4
CatalogNumber:
AA70923
ChemicalName:
N-t-Butyl-2-methoxynicotinamide
CasNumber:
144084-35-5
MolecularFormula:
C11H16N2O2
MolecularWeight:
208.2569
MdlNumber:
MFCD13195783
Smiles:
COc1ncccc1C(=O)NC(C)(C)C
Complexity:
223
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.4