AA92908
174634-09-4 | TAS-103 dihydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AA92908
ChemicalName
TAS-103 dihydrochloride
CasNumber
174634-09-4
MolecularFormula
C20H20ClN3O2
MolecularWeight
369.84470000000005
MdlNumber
MFCD00943251
Smiles
CN(CCNc1nc2cc(O)ccc2c2-c3c(C(=O)c12)cccc3)C.Cl
Complexity
497
Covalently-bondedUnitCount
3
HeavyAtomCount
27
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
4
RotatableBondCount
4
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CatalogNumber: AA92908
ChemicalName: TAS-103 dihydrochloride
CasNumber: 174634-09-4
MolecularFormula: C20H20ClN3O2
MolecularWeight: 369.84470000000005
MdlNumber: MFCD00943251
Smiles: CN(CCNc1nc2cc(O)ccc2c2-c3c(C(=O)c12)cccc3)C.Cl
Complexity: 497
Covalently-bondedUnitCount: 3
HeavyAtomCount: 27
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 4
RotatableBondCount: 4
CatalogNumber:
AA92908
ChemicalName:
TAS-103 dihydrochloride
CasNumber:
174634-09-4
MolecularFormula:
C20H20ClN3O2
MolecularWeight:
369.84470000000005
MdlNumber:
MFCD00943251
Smiles:
CN(CCNc1nc2cc(O)ccc2c2-c3c(C(=O)c12)cccc3)C.Cl
Complexity:
497
Covalently-bondedUnitCount:
3
HeavyAtomCount:
27
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
4
RotatableBondCount:
4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)/C=C/COc1ccc2c(c1C=O)cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)/C=C/COc1ccc2c(c1C=O)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COCN1C(=O)N(C2C1N(COC)C(=O)N2COC)COC
Complexity: 352
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COCN1C(=O)N(C2C1N(COC)C(=O)N2COC)COC
Complexity:
352
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AA92914
ChemicalName: 2-Fluoro-3-hydroxypyridine
CasNumber: 174669-74-0
MolecularFormula: C5H4FNO
MolecularWeight: 113.0898
MdlNumber: MFCD04112569
Smiles: Oc1cccnc1F
Complexity: 78.8
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: __
CatalogNumber:
AA92914
ChemicalName:
2-Fluoro-3-hydroxypyridine
CasNumber:
174669-74-0
MolecularFormula:
C5H4FNO
MolecularWeight:
113.0898
MdlNumber:
MFCD04112569
Smiles:
Oc1cccnc1F
Complexity:
78.8
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
__