(S)-2-[(2-Chloro-6-methyl-4-pyrimidinyl)amino]-3-methyl-1-butanol - CAS 1567944-83-5
Catalog: |
BB011265 |
Product Name: |
(S)-2-[(2-Chloro-6-methyl-4-pyrimidinyl)amino]-3-methyl-1-butanol |
CAS: |
1567944-83-5 |
Synonyms: |
2-[(2-chloro-6-methyl-4-pyrimidinyl)amino]-3-methyl-1-butanol; 2-[(2-chloro-6-methylpyrimidin-4-yl)amino]-3-methylbutan-1-ol |
IUPAC Name: | (2S)-2-[(2-chloro-6-methylpyrimidin-4-yl)amino]-3-methylbutan-1-ol |
Description: | (S)-2-[(2-Chloro-6-methyl-4-pyrimidinyl)amino]-3-methyl-1-butanol (CAS# 1567944-83-5 ) is a useful research chemical. |
Molecular Weight: | 229.71 |
Molecular Formula: | C10H16ClN3O |
Canonical SMILES: | CC1=CC(=NC(=N1)Cl)NC(CO)C(C)C |
InChI: | InChI=1S/C10H16ClN3O/c1-6(2)8(5-15)13-9-4-7(3)12-10(11)14-9/h4,6,8,15H,5H2,1-3H3,(H,12,13,14) |
InChI Key: | FQLCNYGUNMPRGE-UHFFFAOYSA-N |
LogP: | 1.94020 |
Complexity: | 192 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 229.0981898 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 229.0981898 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 58 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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