AD94983
841290-80-0 | 6-(5-fluoro-2-(3,4,5-trimethoxyphenylamino)pyrimidin-4-ylamino)-2,2-dimethyl-2H-pyrido[3,2-b]
Manufacturer: A2B Chem
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CatalogNumber
AD94983
ChemicalName
6-(5-fluoro-2-(3,4,5-trimethoxyphenylamino)pyrimidin-4-ylamino)-2,2-dimethyl-2H-pyrido[3,2-b]
CasNumber
841290-80-0
MolecularFormula
C22H23FN6O5
MolecularWeight
470.4536
MdlNumber
MFCD09970820
Smiles
COc1cc(Nc2ncc(c(n2)Nc2ccc3c(n2)NC(=O)C(O3)(C)C)F)cc(c1OC)OC
Complexity
691
Covalently-bondedUnitCount
1
HeavyAtomCount
34
HydrogenBondAcceptorCount
11
HydrogenBondDonorCount
3
RotatableBondCount
7
Xlogp3
3.1
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CatalogNumber: AD94983
ChemicalName: 6-(5-fluoro-2-(3,4,5-trimethoxyphenylamino)pyrimidin-4-ylamino)-2,2-dimethyl-2H-pyrido[3,2-b]
CasNumber: 841290-80-0
MolecularFormula: C22H23FN6O5
MolecularWeight: 470.4536
MdlNumber: MFCD09970820
Smiles: COc1cc(Nc2ncc(c(n2)Nc2ccc3c(n2)NC(=O)C(O3)(C)C)F)cc(c1OC)OC
Complexity: 691
Covalently-bondedUnitCount: 1
HeavyAtomCount: 34
HydrogenBondAcceptorCount: 11
HydrogenBondDonorCount: 3
RotatableBondCount: 7
Xlogp3: 3.1
CatalogNumber:
AD94983
ChemicalName:
6-(5-fluoro-2-(3,4,5-trimethoxyphenylamino)pyrimidin-4-ylamino)-2,2-dimethyl-2H-pyrido[3,2-b]
CasNumber:
841290-80-0
MolecularFormula:
C22H23FN6O5
MolecularWeight:
470.4536
MdlNumber:
MFCD09970820
Smiles:
COc1cc(Nc2ncc(c(n2)Nc2ccc3c(n2)NC(=O)C(O3)(C)C)F)cc(c1OC)OC
Complexity:
691
Covalently-bondedUnitCount:
1
HeavyAtomCount:
34
HydrogenBondAcceptorCount:
11
HydrogenBondDonorCount:
3
RotatableBondCount:
7
Xlogp3:
3.1
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Smiles: Nc1ccc(cc1N)c1nnn[nH]1
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Nc1ccc(cc1N)c1nnn[nH]1
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Smiles: CN1CC(OCC1)C(=O)O.Cl
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CN1CC(OCC1)C(=O)O.Cl
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Smiles: OC(=O)c1cc2c(n1C)ccs2
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Smiles:
OC(=O)c1cc2c(n1C)ccs2
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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