AA28343
124431-80-7 | CGS 21680 Hydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AA28343
ChemicalName
CGS 21680 Hydrochloride
CasNumber
124431-80-7
MolecularFormula
C23H30ClN7O6
MolecularWeight
535.9806
MdlNumber
MFCD11045878
Smiles
CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N.Cl
Complexity
755
Covalently-bondedUnitCount
2
DefinedAtomStereocenterCount
4
HeavyAtomCount
37
HydrogenBondAcceptorCount
11
HydrogenBondDonorCount
7
RotatableBondCount
10
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CatalogNumber: AA28343
ChemicalName: CGS 21680 Hydrochloride
CasNumber: 124431-80-7
MolecularFormula: C23H30ClN7O6
MolecularWeight: 535.9806
MdlNumber: MFCD11045878
Smiles: CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N.Cl
Complexity: 755
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 4
HeavyAtomCount: 37
HydrogenBondAcceptorCount: 11
HydrogenBondDonorCount: 7
RotatableBondCount: 10
CatalogNumber:
AA28343
ChemicalName:
CGS 21680 Hydrochloride
CasNumber:
124431-80-7
MolecularFormula:
C23H30ClN7O6
MolecularWeight:
535.9806
MdlNumber:
MFCD11045878
Smiles:
CCNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(NCCc1ccc(cc1)CCC(=O)O)nc2N.Cl
Complexity:
755
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
4
HeavyAtomCount:
37
HydrogenBondAcceptorCount:
11
HydrogenBondDonorCount:
7
RotatableBondCount:
10
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCC(C(=O)OCC)O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
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ChemicalName:
__
CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
CCCCC(C(=O)OCC)O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AA28350
ChemicalName: N-Benzyl-N-methyl 2-bromobenzamide
CasNumber: 124461-28-5
MolecularFormula: C15H14BrNO
MolecularWeight: 304.1818
MdlNumber: MFCD00784541
Smiles: Brc1ccccc1C(=O)N(Cc1ccccc1)C
Complexity: 276
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: 3
CatalogNumber:
AA28350
ChemicalName:
N-Benzyl-N-methyl 2-bromobenzamide
CasNumber:
124461-28-5
MolecularFormula:
C15H14BrNO
MolecularWeight:
304.1818
MdlNumber:
MFCD00784541
Smiles:
Brc1ccccc1C(=O)N(Cc1ccccc1)C
Complexity:
276
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1ccccc1C(=O)N1CCCC1
Complexity: 213
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1ccccc1C(=O)N1CCCC1
Complexity:
213
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__