AI64453
955094-26-5 | 2,5-Dioxopyrrolidin-1-yl 3-(2-(2-(3-(2,5-dioxo-2h-pyrrol-1(5h)-yl)propanamido)ethoxy)ethoxy)propanoate
Manufacturer: A2B Chem
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CatalogNumber
AI64453
ChemicalName
2,5-Dioxopyrrolidin-1-yl 3-(2-(2-(3-(2,5-dioxo-2h-pyrrol-1(5h)-yl)propanamido)ethoxy)ethoxy)propanoate
CasNumber
955094-26-5
MolecularFormula
C18H23N3O9
MolecularWeight
425.3899199999999
MdlNumber
MFCD11041137
Smiles
O=C(CCN1C(=O)C=CC1=O)NCCOCCOCCC(=O)ON1C(=O)CCC1=O
Complexity
700
Covalently-bondedUnitCount
1
HeavyAtomCount
30
HydrogenBondAcceptorCount
9
HydrogenBondDonorCount
1
RotatableBondCount
14
Xlogp3
-2.6
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CatalogNumber: AI64453
ChemicalName: 2,5-Dioxopyrrolidin-1-yl 3-(2-(2-(3-(2,5-dioxo-2h-pyrrol-1(5h)-yl)propanamido)ethoxy)ethoxy)propanoate
CasNumber: 955094-26-5
MolecularFormula: C18H23N3O9
MolecularWeight: 425.3899199999999
MdlNumber: MFCD11041137
Smiles: O=C(CCN1C(=O)C=CC1=O)NCCOCCOCCC(=O)ON1C(=O)CCC1=O
Complexity: 700
Covalently-bondedUnitCount: 1
HeavyAtomCount: 30
HydrogenBondAcceptorCount: 9
HydrogenBondDonorCount: 1
RotatableBondCount: 14
Xlogp3: -2.6
CatalogNumber:
AI64453
ChemicalName:
2,5-Dioxopyrrolidin-1-yl 3-(2-(2-(3-(2,5-dioxo-2h-pyrrol-1(5h)-yl)propanamido)ethoxy)ethoxy)propanoate
CasNumber:
955094-26-5
MolecularFormula:
C18H23N3O9
MolecularWeight:
425.3899199999999
MdlNumber:
MFCD11041137
Smiles:
O=C(CCN1C(=O)C=CC1=O)NCCOCCOCCC(=O)ON1C(=O)CCC1=O
Complexity:
700
Covalently-bondedUnitCount:
1
HeavyAtomCount:
30
HydrogenBondAcceptorCount:
9
HydrogenBondDonorCount:
1
RotatableBondCount:
14
Xlogp3:
-2.6
CatalogNumber: __
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Smiles: COc1ccc2c(c1)[n-]c(n2)S(=O)Cc1ncc(c(c1C)OC)C.[Na+]
Complexity: __
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Smiles:
COc1ccc2c(c1)[n-]c(n2)S(=O)Cc1ncc(c(c1C)OC)C.[Na+]
Complexity:
__
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Smiles: O=C(OC(C)(C)C)Nc1nc(ncc1Cl)S(=O)(=O)C
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Smiles:
O=C(OC(C)(C)C)Nc1nc(ncc1Cl)S(=O)(=O)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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Smiles: C1CCN(CC1)P(N1CCCCC1)N1CCCCC1.C1CCN(CC1)P(N1CCCCC1)N1CCCCC1.Cl[Pd]Cl
Complexity: __
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Smiles:
C1CCN(CC1)P(N1CCCCC1)N1CCCCC1.C1CCN(CC1)P(N1CCCCC1)N1CCCCC1.Cl[Pd]Cl
Complexity:
__
Covalently-bondedUnitCount:
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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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