AH90034
905954-28-1 | 1-Amino-3,6,9,12,15,18-hexaoxahenicosan-21-oic acid
Manufacturer: A2B Chem
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CatalogNumber
AH90034
ChemicalName
1-Amino-3,6,9,12,15,18-hexaoxahenicosan-21-oic acid
CasNumber
905954-28-1
MolecularFormula
C15H31NO8
MolecularWeight
353.4085
MdlNumber
MFCD13184943
Smiles
NCCOCCOCCOCCOCCOCCOCCC(=O)O
Complexity
268
Covalently-bondedUnitCount
1
HeavyAtomCount
24
HydrogenBondAcceptorCount
9
HydrogenBondDonorCount
2
RotatableBondCount
20
Xlogp3
-4.4
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CatalogNumber: AH90034
ChemicalName: 1-Amino-3,6,9,12,15,18-hexaoxahenicosan-21-oic acid
CasNumber: 905954-28-1
MolecularFormula: C15H31NO8
MolecularWeight: 353.4085
MdlNumber: MFCD13184943
Smiles: NCCOCCOCCOCCOCCOCCOCCC(=O)O
Complexity: 268
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 9
HydrogenBondDonorCount: 2
RotatableBondCount: 20
Xlogp3: -4.4
CatalogNumber:
AH90034
ChemicalName:
1-Amino-3,6,9,12,15,18-hexaoxahenicosan-21-oic acid
CasNumber:
905954-28-1
MolecularFormula:
C15H31NO8
MolecularWeight:
353.4085
MdlNumber:
MFCD13184943
Smiles:
NCCOCCOCCOCCOCCOCCOCCC(=O)O
Complexity:
268
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
9
HydrogenBondDonorCount:
2
RotatableBondCount:
20
Xlogp3:
-4.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: COc1ccc(cc1)C(=O)c1cccc(c1)CN1CC=CC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COc1ccc(cc1)C(=O)c1cccc(c1)CN1CC=CC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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Smiles: CCOC(=O)C[C@@H](C[C@@H](CC[C@H]1[C@@H](C)C=CC2=C[C@@H](C[C@@H]([C@H]12)OC(=O)C(CC)(C)C)C)O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
CCOC(=O)C[C@@H](C[C@@H](CC[C@H]1[C@@H](C)C=CC2=C[C@@H](C[C@@H]([C@H]12)OC(=O)C(CC)(C)C)C)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)C(=O)c1ccccc1CN1CCCCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)C(=O)c1ccccc1CN1CCCCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__