6-Boc-5,7-dihydropyrrolo[3,4-d]pyrimidine - CAS 1207175-93-6
Catalog: |
BB004944 |
Product Name: |
6-Boc-5,7-dihydropyrrolo[3,4-d]pyrimidine |
CAS: |
1207175-93-6 |
Synonyms: |
5,7-dihydropyrrolo[3,4-d]pyrimidine-6-carboxylic acid tert-butyl ester; tert-butyl 5,7-dihydropyrrolo[3,4-d]pyrimidine-6-carboxylate |
IUPAC Name: | tert-butyl 5,7-dihydropyrrolo[3,4-d]pyrimidine-6-carboxylate |
Description: | 6-Boc-5,7-dihydropyrrolo[3,4-d]pyrimidine (CAS# 1207175-93-6) is a useful research chemical. |
Molecular Weight: | 221.26 |
Molecular Formula: | C11H15N3O2 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CC2=CN=CN=C2C1 |
InChI: | InChI=1S/C11H15N3O2/c1-11(2,3)16-10(15)14-5-8-4-12-7-13-9(8)6-14/h4,7H,5-6H2,1-3H3 |
InChI Key: | ZIXLTKRZAAXURW-UHFFFAOYSA-N |
LogP: | 1.66520 |
Publication Number | Title | Priority Date |
TW-I429640-B | Heterobicyclomethaneamine as a kinase inhibitor | 20081209 |
TW-201018681-A | Pyrimidine compounds, compositions and methods of use | 20080731 |
JP-2010519266-A | Macrocycles as HCV NS3 protease inhibitors | 20070220 |
US-2010240638-A1 | Organic Compounds and their uses | 20070220 |
US-2007286842-A1 | Organic Compounds and Their Uses | 20060411 |
Complexity: | 275 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 221.11642673 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 221.11642673 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 55.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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