AA42198
127132-32-5 | (S)-Ethyl 3-(4-(benzyloxy)phenyl)-2-(tert-butoxycarbonylamino)propanoate
Manufacturer: A2B Chem
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CatalogNumber
AA42198
ChemicalName
(S)-Ethyl 3-(4-(benzyloxy)phenyl)-2-(tert-butoxycarbonylamino)propanoate
CasNumber
127132-32-5
MolecularFormula
C23H29NO5
MolecularWeight
399.4801
MdlNumber
MFCD09833943
Smiles
CCOC(=O)[C@H](Cc1ccc(cc1)OCc1ccccc1)NC(=O)OC(C)(C)C
Complexity
502
Covalently-bondedUnitCount
1
HeavyAtomCount
29
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
11
UndefinedAtomStereocenterCount
1
Xlogp3
4.7
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CatalogNumber: AA42198
ChemicalName: (S)-Ethyl 3-(4-(benzyloxy)phenyl)-2-(tert-butoxycarbonylamino)propanoate
CasNumber: 127132-32-5
MolecularFormula: C23H29NO5
MolecularWeight: 399.4801
MdlNumber: MFCD09833943
Smiles: CCOC(=O)[C@H](Cc1ccc(cc1)OCc1ccccc1)NC(=O)OC(C)(C)C
Complexity: 502
Covalently-bondedUnitCount: 1
HeavyAtomCount: 29
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 11
UndefinedAtomStereocenterCount: 1
Xlogp3: 4.7
CatalogNumber:
AA42198
ChemicalName:
(S)-Ethyl 3-(4-(benzyloxy)phenyl)-2-(tert-butoxycarbonylamino)propanoate
CasNumber:
127132-32-5
MolecularFormula:
C23H29NO5
MolecularWeight:
399.4801
MdlNumber:
MFCD09833943
Smiles:
CCOC(=O)[C@H](Cc1ccc(cc1)OCc1ccccc1)NC(=O)OC(C)(C)C
Complexity:
502
Covalently-bondedUnitCount:
1
HeavyAtomCount:
29
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
11
UndefinedAtomStereocenterCount:
1
Xlogp3:
4.7
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NCc1cc2c([nH]1)c(F)ccc2
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Smiles: Cc1cc(Cl)c2c(n1)c(N)ccc2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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CasNumber:
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MolecularFormula:
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Smiles:
Cc1cc(Cl)c2c(n1)c(N)ccc2
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
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