AV19772
60166-93-0 | Iopamidol
Manufacturer: A2B Chem
The price for this product is unavailable. Please request a quote
CatalogNumber
AV19772
ChemicalName
Iopamidol
CasNumber
60166-93-0
MolecularFormula
C17H22I3N3O8
MolecularWeight
777.0853
MdlNumber
MFCD00867931
Smiles
OCC(NC(=O)c1c(I)c(C(=O)NC(CO)CO)c(c(c1I)NC(=O)[C@@H](O)C)I)CO
NscNumber
759636
Complexity
583
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
31
HydrogenBondAcceptorCount
8
HydrogenBondDonorCount
8
RotatableBondCount
10
Xlogp3
-2.4
Related Products
Compare Similar Items
Show Difference
CatalogNumber: AV19772
ChemicalName: Iopamidol
CasNumber: 60166-93-0
MolecularFormula: C17H22I3N3O8
MolecularWeight: 777.0853
MdlNumber: MFCD00867931
Smiles: OCC(NC(=O)c1c(I)c(C(=O)NC(CO)CO)c(c(c1I)NC(=O)[C@@H](O)C)I)CO
NscNumber: 759636
Complexity: 583
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 31
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: 8
RotatableBondCount: 10
Xlogp3: -2.4
CatalogNumber:
AV19772
ChemicalName:
Iopamidol
CasNumber:
60166-93-0
MolecularFormula:
C17H22I3N3O8
MolecularWeight:
777.0853
MdlNumber:
MFCD00867931
Smiles:
OCC(NC(=O)c1c(I)c(C(=O)NC(CO)CO)c(c(c1I)NC(=O)[C@@H](O)C)I)CO
NscNumber:
759636
Complexity:
583
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
31
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
8
RotatableBondCount:
10
Xlogp3:
-2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N[C@@H](C(=O)O)CSC(C)(C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N[C@@H](C(=O)O)CSC(C)(C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AV19775
ChemicalName: Methotrexate disodium salt
CasNumber: 7413-34-5
MolecularFormula: C20H20N8Na2O5
MolecularWeight: 498.4029
MdlNumber: MFCD00274560
Smiles: [O-]C(=O)CC[C@@H](C(=O)[O-])NC(=O)c1ccc(cc1)N(Cc1cnc2c(n1)c(N)nc(n2)N)C.[Na+].[Na+]
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AV19775
ChemicalName:
Methotrexate disodium salt
CasNumber:
7413-34-5
MolecularFormula:
C20H20N8Na2O5
MolecularWeight:
498.4029
MdlNumber:
MFCD00274560
Smiles:
[O-]C(=O)CC[C@@H](C(=O)[O-])NC(=O)c1ccc(cc1)N(Cc1cnc2c(n1)c(N)nc(n2)N)C.[Na+].[Na+]
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)C1=C(C)NC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OCCN(Cc1ccccc1)C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)C1=C(C)NC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OCCN(Cc1ccccc1)C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__