AV18280
1282582-89-1 | 4,4'-((2-Cyclopropyl-1,4-phenylene)bis(ethyne-2,1-diyl))bis(butylbenzene)
Manufacturer: A2B Chem
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CatalogNumber
AV18280
ChemicalName
4,4'-((2-Cyclopropyl-1,4-phenylene)bis(ethyne-2,1-diyl))bis(butylbenzene)
CasNumber
1282582-89-1
MolecularFormula
C33H34
MolecularWeight
430.6231
MdlNumber
MFCD28991980
Smiles
CCCCc1ccc(cc1)C#Cc1ccc(c(c1)C1CC1)C#Cc1ccc(cc1)CCCC
Complexity
698
Covalently-bondedUnitCount
1
HeavyAtomCount
33
RotatableBondCount
11
Xlogp3
10.6
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CatalogNumber: AV18280
ChemicalName: 4,4'-((2-Cyclopropyl-1,4-phenylene)bis(ethyne-2,1-diyl))bis(butylbenzene)
CasNumber: 1282582-89-1
MolecularFormula: C33H34
MolecularWeight: 430.6231
MdlNumber: MFCD28991980
Smiles: CCCCc1ccc(cc1)C#Cc1ccc(c(c1)C1CC1)C#Cc1ccc(cc1)CCCC
Complexity: 698
Covalently-bondedUnitCount: 1
HeavyAtomCount: 33
RotatableBondCount: 11
Xlogp3: 10.6
CatalogNumber:
AV18280
ChemicalName:
4,4'-((2-Cyclopropyl-1,4-phenylene)bis(ethyne-2,1-diyl))bis(butylbenzene)
CasNumber:
1282582-89-1
MolecularFormula:
C33H34
MolecularWeight:
430.6231
MdlNumber:
MFCD28991980
Smiles:
CCCCc1ccc(cc1)C#Cc1ccc(c(c1)C1CC1)C#Cc1ccc(cc1)CCCC
Complexity:
698
Covalently-bondedUnitCount:
1
HeavyAtomCount:
33
RotatableBondCount:
11
Xlogp3:
10.6
CatalogNumber: AV18281
ChemicalName: N-Isopropyl-1H-indole-5-carboxamide
CasNumber: 953029-91-9
MolecularFormula: C12H14N2O
MolecularWeight: 202.2524
MdlNumber: MFCD13177550
Smiles: CC(NC(=O)c1ccc2c(c1)cc[nH]2)C
Complexity: 240
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AV18281
ChemicalName:
N-Isopropyl-1H-indole-5-carboxamide
CasNumber:
953029-91-9
MolecularFormula:
C12H14N2O
MolecularWeight:
202.2524
MdlNumber:
MFCD13177550
Smiles:
CC(NC(=O)c1ccc2c(c1)cc[nH]2)C
Complexity:
240
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: Cl/C=C(Oc1ccccc1)/Cl
Complexity: __
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HeavyAtomCount: __
RotatableBondCount: __
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Smiles:
Cl/C=C(Oc1ccccc1)/Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: O=C(N[C@H]1CC[C@H]2[C@]1(F)CN(C2)C(=O)OC(C)(C)C)OCc1ccccc1
Complexity: 559
Covalently-bondedUnitCount: __
HeavyAtomCount: __
RotatableBondCount: __
Xlogp3: 3.1
CatalogNumber:
__
ChemicalName:
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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:
O=C(N[C@H]1CC[C@H]2[C@]1(F)CN(C2)C(=O)OC(C)(C)C)OCc1ccccc1
Complexity:
559
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
RotatableBondCount:
__
Xlogp3:
3.1