AF27559
191871-32-6 | Methyl 2-[4-(([(tert-butoxy)carbonyl]amino)methyl)phenyl]acetate
Manufacturer: A2B Chem
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CatalogNumber
AF27559
ChemicalName
Methyl 2-[4-(([(tert-butoxy)carbonyl]amino)methyl)phenyl]acetate
CasNumber
191871-32-6
MolecularFormula
C15H21NO4
MolecularWeight
279.3315
MdlNumber
MFCD09953088
Smiles
COC(=O)Cc1ccc(cc1)CNC(=O)OC(C)(C)C
Complexity
327
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
7
Xlogp3
2.2
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CatalogNumber: AF27559
ChemicalName: Methyl 2-[4-(([(tert-butoxy)carbonyl]amino)methyl)phenyl]acetate
CasNumber: 191871-32-6
MolecularFormula: C15H21NO4
MolecularWeight: 279.3315
MdlNumber: MFCD09953088
Smiles: COC(=O)Cc1ccc(cc1)CNC(=O)OC(C)(C)C
Complexity: 327
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 7
Xlogp3: 2.2
CatalogNumber:
AF27559
ChemicalName:
Methyl 2-[4-(([(tert-butoxy)carbonyl]amino)methyl)phenyl]acetate
CasNumber:
191871-32-6
MolecularFormula:
C15H21NO4
MolecularWeight:
279.3315
MdlNumber:
MFCD09953088
Smiles:
COC(=O)Cc1ccc(cc1)CNC(=O)OC(C)(C)C
Complexity:
327
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
7
Xlogp3:
2.2
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Smiles: OCC=Cc1ccc2c(c1)nc[nH]2
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OCC=Cc1ccc2c(c1)nc[nH]2
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Smiles: CCO[C@@H]1OC(=O)C[C@@H]1NC(=O)[C@@H]1CCCN2N1C(=O)[C@H](CCC2=O)NC(=O)c1nccc2c1cccc2
Complexity: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
CCO[C@@H]1OC(=O)C[C@@H]1NC(=O)[C@@H]1CCCN2N1C(=O)[C@H](CCC2=O)NC(=O)c1nccc2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__