AD11170
99337-98-1 | 2-(Trans-4-hydroxycyclohexyl)-1H-isoindole-1,3(2H)-dione
Manufacturer: A2B Chem
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CatalogNumber
AD11170
ChemicalName
2-(Trans-4-hydroxycyclohexyl)-1H-isoindole-1,3(2H)-dione
CasNumber
99337-98-1
MolecularFormula
C14H15NO3
MolecularWeight
245.2738
MdlNumber
MFCD08460972
Smiles
O[C@@H]1CC[C@H](CC1)N1C(=O)c2c(C1=O)cccc2
NscNumber
150048
Complexity
336
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2
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CatalogNumber: AD11170
ChemicalName: 2-(Trans-4-hydroxycyclohexyl)-1H-isoindole-1,3(2H)-dione
CasNumber: 99337-98-1
MolecularFormula: C14H15NO3
MolecularWeight: 245.2738
MdlNumber: MFCD08460972
Smiles: O[C@@H]1CC[C@H](CC1)N1C(=O)c2c(C1=O)cccc2
NscNumber: 150048
Complexity: 336
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AD11170
ChemicalName:
2-(Trans-4-hydroxycyclohexyl)-1H-isoindole-1,3(2H)-dione
CasNumber:
99337-98-1
MolecularFormula:
C14H15NO3
MolecularWeight:
245.2738
MdlNumber:
MFCD08460972
Smiles:
O[C@@H]1CC[C@H](CC1)N1C(=O)c2c(C1=O)cccc2
NscNumber:
150048
Complexity:
336
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)N=CC(F)(F)F
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)N=CC(F)(F)F
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AD11173
ChemicalName: (3-Methyloxetan-3-yl)methyl p-tosylate
CasNumber: 99314-44-0
MolecularFormula: C12H16O4S
MolecularWeight: 256.318
MdlNumber: MFCD08275394
Smiles: CC1(COS(=O)(=O)c2ccc(cc2)C)COC1
NscNumber: __
Complexity: 345
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 1.7
CatalogNumber:
AD11173
ChemicalName:
(3-Methyloxetan-3-yl)methyl p-tosylate
CasNumber:
99314-44-0
MolecularFormula:
C12H16O4S
MolecularWeight:
256.318
MdlNumber:
MFCD08275394
Smiles:
CC1(COS(=O)(=O)c2ccc(cc2)C)COC1
NscNumber:
__
Complexity:
345
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
1.7
CatalogNumber: AD11184
ChemicalName: Thieno[3,2-c]pyridine-2-carbaldehyde
CasNumber: 94226-19-4
MolecularFormula: C8H5NOS
MolecularWeight: 163.1964
MdlNumber: MFCD18453108
Smiles: O=Cc1cc2c(s1)ccnc2
NscNumber: __
Complexity: 162
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 1.7
CatalogNumber:
AD11184
ChemicalName:
Thieno[3,2-c]pyridine-2-carbaldehyde
CasNumber:
94226-19-4
MolecularFormula:
C8H5NOS
MolecularWeight:
163.1964
MdlNumber:
MFCD18453108
Smiles:
O=Cc1cc2c(s1)ccnc2
NscNumber:
__
Complexity:
162
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
1.7