AV18843
2102411-12-9 | (S)-5-Bromomethyl-3-Methyl-Oxazolidin-2-One
Manufacturer: A2B Chem
CAS Number: 2102411-12-9
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Catalog Number
AV18843
Chemical Name
(S)-5-Bromomethyl-3-Methyl-Oxazolidin-2-One
Cas Number
2102411-12-9
Molecular Formula
C5H8BrNO2
Molecular Weight
194.0265
Smiles
CN1C[C@H](OC1=O)CBr
Complexity
128
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
1
Heavy Atom Count
9
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Xlogp3
0.7
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Catalog Number: AV18843
Chemical Name: (S)-5-Bromomethyl-3-Methyl-Oxazolidin-2-One
Cas Number: 2102411-12-9
Molecular Formula: C5H8BrNO2
Molecular Weight: 194.0265
Smiles: CN1C[C@H](OC1=O)CBr
Complexity: 128
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 1
Heavy Atom Count: 9
Hydrogen Bond Acceptor Count: 2
Rotatable Bond Count: 1
Xlogp3: 0.7
Catalog Number:
AV18843
Chemical Name:
(S)-5-Bromomethyl-3-Methyl-Oxazolidin-2-One
Cas Number:
2102411-12-9
Molecular Formula:
C5H8BrNO2
Molecular Weight:
194.0265
Smiles:
CN1C[C@H](OC1=O)CBr
Complexity:
128
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Xlogp3:
0.7
Catalog Number: AV18844
Chemical Name: 2-(2-Nitrophenyl)dibenzo[b,d]furan
Cas Number: 1246308-82-6
Molecular Formula: C18H11NO3
Molecular Weight: 289.2848
Smiles: [O-][N+](=O)c1ccccc1c1ccc2c(c1)c1ccccc1o2
Complexity: 421
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: __
Heavy Atom Count: 22
Hydrogen Bond Acceptor Count: 3
Rotatable Bond Count: 1
Xlogp3: 5.1
Catalog Number:
AV18844
Chemical Name:
2-(2-Nitrophenyl)dibenzo[b,d]furan
Cas Number:
1246308-82-6
Molecular Formula:
C18H11NO3
Molecular Weight:
289.2848
Smiles:
[O-][N+](=O)c1ccccc1c1ccc2c(c1)c1ccccc1o2
Complexity:
421
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
__
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Xlogp3:
5.1
Catalog Number: __
Chemical Name: __
Cas Number: __
Molecular Formula: __
Molecular Weight: __
Smiles: OC(=O)CNCc1ccccc1[N+](=O)[O-]
Complexity: 239
Covalently-Bonded Unit Count: __
Defined Atom Stereocenter Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Rotatable Bond Count: __
Xlogp3: -1.2
Catalog Number:
__
Chemical Name:
__
Cas Number:
__
Molecular Formula:
__
Molecular Weight:
__
Smiles:
OC(=O)CNCc1ccccc1[N+](=O)[O-]
Complexity:
239
Covalently-Bonded Unit Count:
__
Defined Atom Stereocenter Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Rotatable Bond Count:
__
Xlogp3:
-1.2
Catalog Number: AV18846
Chemical Name: (R)-N-((S)-1-(4-Bromophenyl)-2,2,2-trifluoroethyl)-2-methylpropane-2-sulfinamide
Cas Number: 336105-31-8
Molecular Formula: C12H15BrF3NOS
Molecular Weight: 358.2178
Smiles: FC([C@H](c1ccc(cc1)Br)N[S@](=O)C(C)(C)C)(F)F
Complexity: 322
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 2
Heavy Atom Count: 19
Hydrogen Bond Acceptor Count: 6
Rotatable Bond Count: 4
Xlogp3: 4
Catalog Number:
AV18846
Chemical Name:
(R)-N-((S)-1-(4-Bromophenyl)-2,2,2-trifluoroethyl)-2-methylpropane-2-sulfinamide
Cas Number:
336105-31-8
Molecular Formula:
C12H15BrF3NOS
Molecular Weight:
358.2178
Smiles:
FC([C@H](c1ccc(cc1)Br)N[S@](=O)C(C)(C)C)(F)F
Complexity:
322
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
4
Xlogp3:
4