AB58434
612487-72-6 | 2-hydroxy-3-[5-(4-morpholinylmethyl)-2-pyridinyl]-1H-indole-5-carbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AB58434
ChemicalName
2-hydroxy-3-[5-(4-morpholinylmethyl)-2-pyridinyl]-1H-indole-5-carbonitrile
CasNumber
612487-72-6
MolecularFormula
C19H18N4O2
MolecularWeight
334.3718
MdlNumber
MFCD12031593
Smiles
N#Cc1ccc2c(c1)c(c1ccc(cn1)CN1CCOCC1)c([nH]2)O
Complexity
501
Covalently-bondedUnitCount
1
HeavyAtomCount
25
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
1.8
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CatalogNumber: AB58434
ChemicalName: 2-hydroxy-3-[5-(4-morpholinylmethyl)-2-pyridinyl]-1H-indole-5-carbonitrile
CasNumber: 612487-72-6
MolecularFormula: C19H18N4O2
MolecularWeight: 334.3718
MdlNumber: MFCD12031593
Smiles: N#Cc1ccc2c(c1)c(c1ccc(cn1)CN1CCOCC1)c([nH]2)O
Complexity: 501
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 1.8
CatalogNumber:
AB58434
ChemicalName:
2-hydroxy-3-[5-(4-morpholinylmethyl)-2-pyridinyl]-1H-indole-5-carbonitrile
CasNumber:
612487-72-6
MolecularFormula:
C19H18N4O2
MolecularWeight:
334.3718
MdlNumber:
MFCD12031593
Smiles:
N#Cc1ccc2c(c1)c(c1ccc(cn1)CN1CCOCC1)c([nH]2)O
Complexity:
501
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC(=O)c1ccc2c(c1)cc[nH]2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC(=O)c1ccc2c(c1)cc[nH]2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB58436
ChemicalName: 2-((6-(Chloromethyl)pyridin-2-yl)methyl)isoindoline-1,3-dione
CasNumber: 628308-52-1
MolecularFormula: C15H11ClN2O2
MolecularWeight: 286.713
MdlNumber: MFCD28159324
Smiles: ClCc1cccc(n1)CN1C(=O)c2c(C1=O)cccc2
Complexity: 377
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 1.8
CatalogNumber:
AB58436
ChemicalName:
2-((6-(Chloromethyl)pyridin-2-yl)methyl)isoindoline-1,3-dione
CasNumber:
628308-52-1
MolecularFormula:
C15H11ClN2O2
MolecularWeight:
286.713
MdlNumber:
MFCD28159324
Smiles:
ClCc1cccc(n1)CN1C(=O)c2c(C1=O)cccc2
Complexity:
377
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Complexity: 323
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 4.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Complexity:
323
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
4.9