AC90585
919111-34-5 | 1-[(2,4-Dimethoxyphenyl)methyl]-4-(hydroxymethyl)pyrrolidin-2-one
Manufacturer: A2B Chem
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CatalogNumber
AC90585
ChemicalName
1-[(2,4-Dimethoxyphenyl)methyl]-4-(hydroxymethyl)pyrrolidin-2-one
CasNumber
919111-34-5
MolecularFormula
C14H19NO4
MolecularWeight
265.30496
MdlNumber
MFCD19434623
Smiles
OCC1CC(=O)N(C1)Cc1ccc(cc1OC)OC
Complexity
310
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
5
UndefinedAtomStereocenterCount
1
Xlogp3
0.4
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CatalogNumber: AC90585
ChemicalName: 1-[(2,4-Dimethoxyphenyl)methyl]-4-(hydroxymethyl)pyrrolidin-2-one
CasNumber: 919111-34-5
MolecularFormula: C14H19NO4
MolecularWeight: 265.30496
MdlNumber: MFCD19434623
Smiles: OCC1CC(=O)N(C1)Cc1ccc(cc1OC)OC
Complexity: 310
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 5
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.4
CatalogNumber:
AC90585
ChemicalName:
1-[(2,4-Dimethoxyphenyl)methyl]-4-(hydroxymethyl)pyrrolidin-2-one
CasNumber:
919111-34-5
MolecularFormula:
C14H19NO4
MolecularWeight:
265.30496
MdlNumber:
MFCD19434623
Smiles:
OCC1CC(=O)N(C1)Cc1ccc(cc1OC)OC
Complexity:
310
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.4
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Smiles: ClCC(=O)N1CCCC1(C)C
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Smiles:
ClCC(=O)N1CCCC1(C)C
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HydrogenBondAcceptorCount:
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Smiles: ClCc1cc(cc(c1O)C=O)C(C)(C)C
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Smiles:
ClCc1cc(cc(c1O)C=O)C(C)(C)C
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HydrogenBondAcceptorCount:
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Smiles: c1ccc(cc1)P(c1ccccc1Sc1ccccc1P(c1ccccc1)c1ccccc1)c1ccccc1
Complexity: __
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UndefinedAtomStereocenterCount: __
Xlogp3: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
c1ccc(cc1)P(c1ccccc1Sc1ccccc1P(c1ccccc1)c1ccccc1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__