AA27847
124184-67-4 | (R)-2-((tert-Butoxycarbonyl)amino)-4-methoxy-4-oxobutanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AA27847
ChemicalName
(R)-2-((tert-Butoxycarbonyl)amino)-4-methoxy-4-oxobutanoic acid
CasNumber
124184-67-4
MolecularFormula
C10H17NO6
MolecularWeight
247.2451
MdlNumber
MFCD11617949
Smiles
COC(=O)C[C@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity
306
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
7
Xlogp3
0.4
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CatalogNumber: AA27847
ChemicalName: (R)-2-((tert-Butoxycarbonyl)amino)-4-methoxy-4-oxobutanoic acid
CasNumber: 124184-67-4
MolecularFormula: C10H17NO6
MolecularWeight: 247.2451
MdlNumber: MFCD11617949
Smiles: COC(=O)C[C@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity: 306
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 0.4
CatalogNumber:
AA27847
ChemicalName:
(R)-2-((tert-Butoxycarbonyl)amino)-4-methoxy-4-oxobutanoic acid
CasNumber:
124184-67-4
MolecularFormula:
C10H17NO6
MolecularWeight:
247.2451
MdlNumber:
MFCD11617949
Smiles:
COC(=O)C[C@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity:
306
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
0.4
CatalogNumber: __
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Smiles: CCNC(=O)C1OC(C(C1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N
Complexity: __
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Smiles:
CCNC(=O)C1OC(C(C1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N
Complexity:
__
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Smiles: N#Cc1ccc2c(c1)nccc2Br
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Smiles:
N#Cc1ccc2c(c1)nccc2Br
Complexity:
__
Covalently-bondedUnitCount:
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DefinedAtomStereocenterCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: COC(=O)CCC1=CC=C2[N-]1[B+3]([F-])([F-])[N]1=C(C)C=C(C1=C2)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)CCC1=CC=C2[N-]1[B+3]([F-])([F-])[N]1=C(C)C=C(C1=C2)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__