AB34343
285983-48-4 | 3-[3-tert-butyl-1-(4-methylphenyl)-1H-pyrazol-5-yl]-1-{4-[2-(morpholin-4-yl)ethoxy]naphthalen-1-yl}urea
Manufacturer: A2B Chem
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CatalogNumber
AB34343
ChemicalName
3-[3-tert-butyl-1-(4-methylphenyl)-1H-pyrazol-5-yl]-1-{4-[2-(morpholin-4-yl)ethoxy]naphthalen-1-yl}urea
CasNumber
285983-48-4
MolecularFormula
C31H37N5O3
MolecularWeight
527.6572
MdlNumber
MFCD09752957
Smiles
O=C(Nc1cc(nn1c1ccc(cc1)C)C(C)(C)C)Nc1ccc(c2c1cccc2)OCCN1CCOCC1
Complexity
777
Covalently-bondedUnitCount
1
HeavyAtomCount
39
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
8
Xlogp3
5.7
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CatalogNumber: AB34343
ChemicalName: 3-[3-tert-butyl-1-(4-methylphenyl)-1H-pyrazol-5-yl]-1-{4-[2-(morpholin-4-yl)ethoxy]naphthalen-1-yl}urea
CasNumber: 285983-48-4
MolecularFormula: C31H37N5O3
MolecularWeight: 527.6572
MdlNumber: MFCD09752957
Smiles: O=C(Nc1cc(nn1c1ccc(cc1)C)C(C)(C)C)Nc1ccc(c2c1cccc2)OCCN1CCOCC1
Complexity: 777
Covalently-bondedUnitCount: 1
HeavyAtomCount: 39
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 8
Xlogp3: 5.7
CatalogNumber:
AB34343
ChemicalName:
3-[3-tert-butyl-1-(4-methylphenyl)-1H-pyrazol-5-yl]-1-{4-[2-(morpholin-4-yl)ethoxy]naphthalen-1-yl}urea
CasNumber:
285983-48-4
MolecularFormula:
C31H37N5O3
MolecularWeight:
527.6572
MdlNumber:
MFCD09752957
Smiles:
O=C(Nc1cc(nn1c1ccc(cc1)C)C(C)(C)C)Nc1ccc(c2c1cccc2)OCCN1CCOCC1
Complexity:
777
Covalently-bondedUnitCount:
1
HeavyAtomCount:
39
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
8
Xlogp3:
5.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1scc(n1)CC12CC3CC(C2)CC(C1)C3
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1scc(n1)CC12CC3CC(C2)CC(C1)C3
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB34345
ChemicalName: 5-Bromo-2,4-dimethyl-1,3-thiazole
CasNumber: 28599-52-2
MolecularFormula: C5H6BrNS
MolecularWeight: 192.0768
MdlNumber: MFCD03086099
Smiles: Cc1sc(c(n1)C)Br
Complexity: 88.5
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.8
CatalogNumber:
AB34345
ChemicalName:
5-Bromo-2,4-dimethyl-1,3-thiazole
CasNumber:
28599-52-2
MolecularFormula:
C5H6BrNS
MolecularWeight:
192.0768
MdlNumber:
MFCD03086099
Smiles:
Cc1sc(c(n1)C)Br
Complexity:
88.5
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1CC2OC2CCC2C1O2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1CC2OC2CCC2C1O2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__