AB51792
6093-03-4 | [1,1':3',1''-Terphenyl]-4'-ol
Manufacturer: A2B Chem
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CatalogNumber
AB51792
ChemicalName
[1,1':3',1''-Terphenyl]-4'-ol
CasNumber
6093-03-4
MolecularFormula
C18H14O
MolecularWeight
246.3032
MdlNumber
MFCD00832415
Smiles
Oc1ccc(cc1c1ccccc1)c1ccccc1
Complexity
263
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
4.7
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CatalogNumber: AB51792
ChemicalName: [1,1':3',1''-Terphenyl]-4'-ol
CasNumber: 6093-03-4
MolecularFormula: C18H14O
MolecularWeight: 246.3032
MdlNumber: MFCD00832415
Smiles: Oc1ccc(cc1c1ccccc1)c1ccccc1
Complexity: 263
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 4.7
CatalogNumber:
AB51792
ChemicalName:
[1,1':3',1''-Terphenyl]-4'-ol
CasNumber:
6093-03-4
MolecularFormula:
C18H14O
MolecularWeight:
246.3032
MdlNumber:
MFCD00832415
Smiles:
Oc1ccc(cc1c1ccccc1)c1ccccc1
Complexity:
263
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
4.7
CatalogNumber: AB51793
ChemicalName: Erythromycin
CasNumber: 114-07-8
MolecularFormula: C37H67NO13
MolecularWeight: 733.9267800000002
MdlNumber: MFCD00149235
Smiles: CC[C@H]1OC(=O)[C@H](C)[C@@H](C[C@H]2C[C@@](C)(OC)[C@H]([C@@H](O2)O)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O
Complexity: 1180
Covalently-bondedUnitCount: 1
HeavyAtomCount: 51
HydrogenBondAcceptorCount: 14
HydrogenBondDonorCount: 5
RotatableBondCount: 7
Xlogp3: 2.7
CatalogNumber:
AB51793
ChemicalName:
Erythromycin
CasNumber:
114-07-8
MolecularFormula:
C37H67NO13
MolecularWeight:
733.9267800000002
MdlNumber:
MFCD00149235
Smiles:
CC[C@H]1OC(=O)[C@H](C)[C@@H](C[C@H]2C[C@@](C)(OC)[C@H]([C@@H](O2)O)O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@H]([C@]1(C)O)O)C)C)(C)O
Complexity:
1180
Covalently-bondedUnitCount:
1
HeavyAtomCount:
51
HydrogenBondAcceptorCount:
14
HydrogenBondDonorCount:
5
RotatableBondCount:
7
Xlogp3:
2.7
CatalogNumber: AB51794
ChemicalName: 1-cyclopropyl-7-(4-ethylpiperazin-1-yl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
CasNumber: 93106-60-6
MolecularFormula: C19H22FN3O3
MolecularWeight: 359.3947
MdlNumber: MFCD00792463
Smiles: CCN1CCN(CC1)c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)O
Complexity: 613
Covalently-bondedUnitCount: 1
HeavyAtomCount: 26
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: -0.2
CatalogNumber:
AB51794
ChemicalName:
1-cyclopropyl-7-(4-ethylpiperazin-1-yl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
CasNumber:
93106-60-6
MolecularFormula:
C19H22FN3O3
MolecularWeight:
359.3947
MdlNumber:
MFCD00792463
Smiles:
CCN1CCN(CC1)c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)O
Complexity:
613
Covalently-bondedUnitCount:
1
HeavyAtomCount:
26
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
-0.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(C(c1ccc(cc1)O)N)NC1C(=O)N2C1SC(C2C(=O)O)(C)C.O.O.O
Complexity: 590
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(C(c1ccc(cc1)O)N)NC1C(=O)N2C1SC(C2C(=O)O)(C)C.O.O.O
Complexity:
590
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__