AA22145
115964-29-9 | Tosufloxacin tosilate
Manufacturer: A2B Chem
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CatalogNumber
AA22145
ChemicalName
Tosufloxacin tosilate
CasNumber
115964-29-9
MolecularFormula
C26H23F3N4O6S
MolecularWeight
576.5442
MdlNumber
MFCD01711971
Smiles
Cc1ccc(cc1)S(=O)(=O)O.NC1CCN(C1)c1nc2n(cc(c(=O)c2cc1F)C(=O)O)c1ccc(cc1F)F
Complexity
915
Covalently-bondedUnitCount
2
HeavyAtomCount
40
HydrogenBondAcceptorCount
13
HydrogenBondDonorCount
3
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
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CatalogNumber: AA22145
ChemicalName: Tosufloxacin tosilate
CasNumber: 115964-29-9
MolecularFormula: C26H23F3N4O6S
MolecularWeight: 576.5442
MdlNumber: MFCD01711971
Smiles: Cc1ccc(cc1)S(=O)(=O)O.NC1CCN(C1)c1nc2n(cc(c(=O)c2cc1F)C(=O)O)c1ccc(cc1F)F
Complexity: 915
Covalently-bondedUnitCount: 2
HeavyAtomCount: 40
HydrogenBondAcceptorCount: 13
HydrogenBondDonorCount: 3
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AA22145
ChemicalName:
Tosufloxacin tosilate
CasNumber:
115964-29-9
MolecularFormula:
C26H23F3N4O6S
MolecularWeight:
576.5442
MdlNumber:
MFCD01711971
Smiles:
Cc1ccc(cc1)S(=O)(=O)O.NC1CCN(C1)c1nc2n(cc(c(=O)c2cc1F)C(=O)O)c1ccc(cc1F)F
Complexity:
915
Covalently-bondedUnitCount:
2
HeavyAtomCount:
40
HydrogenBondAcceptorCount:
13
HydrogenBondDonorCount:
3
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1n[nH]c(c1Cl)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1n[nH]c(c1Cl)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
CatalogNumber: AA22148
ChemicalName: 3-(Benzylamino)oxetane-3-carboxylic acid
CasNumber: 1159738-31-4
MolecularFormula: C11H13NO3
MolecularWeight: 207.2258
MdlNumber: MFCD22370042
Smiles: OC(=O)C1(NCc2ccccc2)COC1
Complexity: 232
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
UndefinedAtomStereocenterCount: __
CatalogNumber:
AA22148
ChemicalName:
3-(Benzylamino)oxetane-3-carboxylic acid
CasNumber:
1159738-31-4
MolecularFormula:
C11H13NO3
MolecularWeight:
207.2258
MdlNumber:
MFCD22370042
Smiles:
OC(=O)C1(NCc2ccccc2)COC1
Complexity:
232
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(NC1(COC1)C(=O)O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(NC1(COC1)C(=O)O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__