AA42238
127192-72-7 | 2-(4-([2,2':6',2''-Terpyridin]-4'-yl)phenoxy)ethanol
Manufacturer: A2B Chem
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CatalogNumber
AA42238
ChemicalName
2-(4-([2,2':6',2''-Terpyridin]-4'-yl)phenoxy)ethanol
CasNumber
127192-72-7
MolecularFormula
C23H19N3O2
MolecularWeight
369.4159
MdlNumber
MFCD30533850
Smiles
OCCOc1ccc(cc1)c1cc(nc(c1)c1ccccn1)c1ccccn1
NscNumber
640499
Complexity
429
Covalently-bondedUnitCount
1
HeavyAtomCount
28
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
6
Xlogp3
3
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CatalogNumber: AA42238
ChemicalName: 2-(4-([2,2':6',2''-Terpyridin]-4'-yl)phenoxy)ethanol
CasNumber: 127192-72-7
MolecularFormula: C23H19N3O2
MolecularWeight: 369.4159
MdlNumber: MFCD30533850
Smiles: OCCOc1ccc(cc1)c1cc(nc(c1)c1ccccn1)c1ccccn1
NscNumber: 640499
Complexity: 429
Covalently-bondedUnitCount: 1
HeavyAtomCount: 28
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 6
Xlogp3: 3
CatalogNumber:
AA42238
ChemicalName:
2-(4-([2,2':6',2''-Terpyridin]-4'-yl)phenoxy)ethanol
CasNumber:
127192-72-7
MolecularFormula:
C23H19N3O2
MolecularWeight:
369.4159
MdlNumber:
MFCD30533850
Smiles:
OCCOc1ccc(cc1)c1cc(nc(c1)c1ccccn1)c1ccccn1
NscNumber:
640499
Complexity:
429
Covalently-bondedUnitCount:
1
HeavyAtomCount:
28
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
6
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc2c(c1)oc(=O)c(c2)Nc1nc(F)nc(n1)F
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc2c(c1)oc(=O)c(c2)Nc1nc(F)nc(n1)F
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA42240
ChemicalName: KN-62
CasNumber: 127191-97-3
MolecularFormula: C38H35N5O6S2
MolecularWeight: 721.8444
MdlNumber: MFCD00083180
Smiles: O=C([C@H](Cc1ccc(cc1)OS(=O)(=O)c1cccc2c1ccnc2)NCS(=O)(=O)c1cccc2c1ccnc2)N1CCN(CC1)c1ccccc1
NscNumber: __
Complexity: 1370
Covalently-bondedUnitCount: 1
HeavyAtomCount: 51
HydrogenBondAcceptorCount: 10
HydrogenBondDonorCount: __
RotatableBondCount: 10
Xlogp3: 5.6
CatalogNumber:
AA42240
ChemicalName:
KN-62
CasNumber:
127191-97-3
MolecularFormula:
C38H35N5O6S2
MolecularWeight:
721.8444
MdlNumber:
MFCD00083180
Smiles:
O=C([C@H](Cc1ccc(cc1)OS(=O)(=O)c1cccc2c1ccnc2)NCS(=O)(=O)c1cccc2c1ccnc2)N1CCN(CC1)c1ccccc1
NscNumber:
__
Complexity:
1370
Covalently-bondedUnitCount:
1
HeavyAtomCount:
51
HydrogenBondAcceptorCount:
10
HydrogenBondDonorCount:
__
RotatableBondCount:
10
Xlogp3:
5.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1cccc(n1)N1CCN(CC1)C(=O)OC(C)(C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1cccc(n1)N1CCN(CC1)C(=O)OC(C)(C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__