(S)-3-(2-Chloro-6-methyl-4-pyrimidyl)-4-isopropyl-2-oxazolidinone - CAS 1429180-99-3
Catalog: |
BB009467 |
Product Name: |
(S)-3-(2-Chloro-6-methyl-4-pyrimidyl)-4-isopropyl-2-oxazolidinone |
CAS: |
1429180-99-3 |
Synonyms: |
(4S)-3-(2-chloro-6-methyl-4-pyrimidinyl)-4-propan-2-yl-2-oxazolidinone; (4S)-3-(2-chloro-6-methylpyrimidin-4-yl)-4-propan-2-yl-1,3-oxazolidin-2-one |
IUPAC Name: | (4S)-3-(2-chloro-6-methylpyrimidin-4-yl)-4-propan-2-yl-1,3-oxazolidin-2-one |
Description: | (S)-3-(2-Chloro-6-methyl-4-pyrimidyl)-4-isopropyl-2-oxazolidinone (CAS# 1429180-99-3 ) is a useful research chemical. |
Molecular Weight: | 255.70 |
Molecular Formula: | C11H14ClN3O2 |
Canonical SMILES: | CC1=CC(=NC(=N1)Cl)N2C(COC2=O)C(C)C |
InChI: | InChI=1S/C11H14ClN3O2/c1-6(2)8-5-17-11(16)15(8)9-4-7(3)13-10(12)14-9/h4,6,8H,5H2,1-3H3/t8-/m1/s1 |
InChI Key: | KUHPPZCNOWLVCO-MRVPVSSYSA-N |
LogP: | 2.48460 |
Publication Number | Title | Priority Date |
EP-2771337-B1 | 3-(pyrimidin-4-yl)-oxazolidin-2-ones as inhibitors of mutant idh | 20110927 |
ES-2645968-T3 | 3- (pyrimidin-4-yl) -oxazolidin-2-ones as mutant HDI inhibitors | 20110927 |
US-2014235620-A1 | 3-pyrimidin-4-yl-oxazolidin-2-ones as inhibitors of mutant idh | 20110927 |
US-8957068-B2 | 3-pyrimidin-4-yl-oxazolidin-2-ones as inhibitors of mutant IDH | 20110927 |
WO-2013046136-A1 | 3-pyrimidin-4-yl-oxazolidin-2-ones as inhibitors of mutant idh | 20110927 |
Complexity: | 300 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 255.0774544 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 255.0774544 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 55.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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