AB34476
286370-15-8 | 1-{2-Chloro-4-[(6,7-dimethoxyquinazolin-4-yl)oxy]phenyl}-3-propylurea
Manufacturer: A2B Chem
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CatalogNumber
AB34476
ChemicalName
1-{2-Chloro-4-[(6,7-dimethoxyquinazolin-4-yl)oxy]phenyl}-3-propylurea
CasNumber
286370-15-8
MolecularFormula
C20H21ClN4O4
MolecularWeight
416.8581
MdlNumber
MFCD14155620
Smiles
CCCNC(=O)Nc1ccc(cc1Cl)Oc1ncnc2c1cc(OC)c(c2)OC
Complexity
529
Covalently-bondedUnitCount
1
HeavyAtomCount
29
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
7
Xlogp3
3.9
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CatalogNumber: AB34476
ChemicalName: 1-{2-Chloro-4-[(6,7-dimethoxyquinazolin-4-yl)oxy]phenyl}-3-propylurea
CasNumber: 286370-15-8
MolecularFormula: C20H21ClN4O4
MolecularWeight: 416.8581
MdlNumber: MFCD14155620
Smiles: CCCNC(=O)Nc1ccc(cc1Cl)Oc1ncnc2c1cc(OC)c(c2)OC
Complexity: 529
Covalently-bondedUnitCount: 1
HeavyAtomCount: 29
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 3.9
CatalogNumber:
AB34476
ChemicalName:
1-{2-Chloro-4-[(6,7-dimethoxyquinazolin-4-yl)oxy]phenyl}-3-propylurea
CasNumber:
286370-15-8
MolecularFormula:
C20H21ClN4O4
MolecularWeight:
416.8581
MdlNumber:
MFCD14155620
Smiles:
CCCNC(=O)Nc1ccc(cc1Cl)Oc1ncnc2c1cc(OC)c(c2)OC
Complexity:
529
Covalently-bondedUnitCount:
1
HeavyAtomCount:
29
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
3.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#C[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@H]([C@@H]([C@H]1OC(=O)c1ccccc1)OC(=O)c1ccccc1)OC(=O)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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Smiles:
N#C[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@H]([C@@H]([C@H]1OC(=O)c1ccccc1)OC(=O)c1ccccc1)OC(=O)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: NC(=S)SC(c1cscc1)CC(=O)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC(=S)SC(c1cscc1)CC(=O)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB34485
ChemicalName: 4-(Hydroxymethyl)-3,5-dimethylphenol
CasNumber: 28636-93-3
MolecularFormula: C9H12O2
MolecularWeight: 152.19038000000003
MdlNumber: MFCD03411743
Smiles: OCc1c(C)cc(cc1C)O
Complexity: 113
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.4
CatalogNumber:
AB34485
ChemicalName:
4-(Hydroxymethyl)-3,5-dimethylphenol
CasNumber:
28636-93-3
MolecularFormula:
C9H12O2
MolecularWeight:
152.19038000000003
MdlNumber:
MFCD03411743
Smiles:
OCc1c(C)cc(cc1C)O
Complexity:
113
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.4