AA55690
1223397-11-2 | Wzb117
Manufacturer: A2B Chem
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CatalogNumber
AA55690
ChemicalName
Wzb117
CasNumber
1223397-11-2
MolecularFormula
C20H13FO6
MolecularWeight
368.312
MdlNumber
MFCD24387113
Smiles
Oc1cccc(c1)C(=O)Oc1c(cccc1F)OC(=O)c1cccc(c1)O
NscNumber
750937
Complexity
527
Covalently-bondedUnitCount
1
HeavyAtomCount
27
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
2
RotatableBondCount
6
Xlogp3
4.1
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CatalogNumber: AA55690
ChemicalName: Wzb117
CasNumber: 1223397-11-2
MolecularFormula: C20H13FO6
MolecularWeight: 368.312
MdlNumber: MFCD24387113
Smiles: Oc1cccc(c1)C(=O)Oc1c(cccc1F)OC(=O)c1cccc(c1)O
NscNumber: 750937
Complexity: 527
Covalently-bondedUnitCount: 1
HeavyAtomCount: 27
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 6
Xlogp3: 4.1
CatalogNumber:
AA55690
ChemicalName:
Wzb117
CasNumber:
1223397-11-2
MolecularFormula:
C20H13FO6
MolecularWeight:
368.312
MdlNumber:
MFCD24387113
Smiles:
Oc1cccc(c1)C(=O)Oc1c(cccc1F)OC(=O)c1cccc(c1)O
NscNumber:
750937
Complexity:
527
Covalently-bondedUnitCount:
1
HeavyAtomCount:
27
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
6
Xlogp3:
4.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC1(OOC21C1CC3CC2CC(C1)C3)c1cccc(c1)OP(=O)(O)O
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC1(OOC21C1CC3CC2CC(C1)C3)c1cccc(c1)OP(=O)(O)O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Oc1cccc(c1)C1=C2CCC(=N2)C(=c2ccc(=C(C3=NC(=C(c4[nH]c1cc4)c1cccc(c1)O)C=C3)c1cccc(c1)O)[nH]2)c1cccc(c1)O
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Oc1cccc(c1)C1=C2CCC(=N2)C(=c2ccc(=C(C3=NC(=C(c4[nH]c1cc4)c1cccc(c1)O)C=C3)c1cccc(c1)O)[nH]2)c1cccc(c1)O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CON(C(=O)c1ccc(cc1)Cl)C
NscNumber: __
Complexity: 179
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CON(C(=O)c1ccc(cc1)Cl)C
NscNumber:
__
Complexity:
179
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.1