(S)-4-Oxo-4,6,7,8-tetrahydropyrrolo[1,2-a]pyrimidine-6-carboxylic Acid - CAS 1190392-22-3
Catalog: |
BB004402 |
Product Name: |
(S)-4-Oxo-4,6,7,8-tetrahydropyrrolo[1,2-a]pyrimidine-6-carboxylic Acid |
CAS: |
1190392-22-3 |
Synonyms: |
(6S)-4-oxo-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidine-6-carboxylic acid; (6S)-4-oxo-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidine-6-carboxylic acid |
IUPAC Name: | (6S)-4-oxo-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidine-6-carboxylic acid |
Description: | (S)-4-Oxo-4,6,7,8-tetrahydropyrrolo[1,2-a]pyrimidine-6-carboxylic Acid (CAS# 1190392-22-3 ) is a useful research chemical. |
Molecular Weight: | 180.16 |
Molecular Formula: | C8H8N2O3 |
Canonical SMILES: | C1CC2=NC=CC(=O)N2C1C(=O)O |
InChI: | InChI=1S/C8H8N2O3/c11-7-3-4-9-6-2-1-5(8(12)13)10(6)7/h3-5H,1-2H2,(H,12,13)/t5-/m0/s1 |
InChI Key: | VBGNTNJINOCQNQ-YFKPBYRVSA-N |
LogP: | -0.18480 |
Publication Number | Title | Priority Date |
US-10287289-B2 | Process for preparing beta 3 agonists and intermediates | 20130315 |
US-2017145014-A1 | Process for preparing beta 3 agonists and intermediates | 20130315 |
WO-2014150639-A1 | Process for preparing beta 3 agonists and intermediates | 20130315 |
EP-2770996-B1 | Process for making beta 3 agonists and intermediates | 20111027 |
US-10087189-B2 | Process for making beta 3 agonists and intermediates | 20111027 |
Complexity: | 332 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 180.05349212 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 180.05349212 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 70 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.8 |
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