Cyclopenta[c]fluorene, 2,4-dimethyl-7,8,9,10-tetrahydro-6-thia-1,3,3a,5-tetraaza-
Basic information
- CAS
77995-51-8- Standard SMILES
Cc1nc2c3c4c(sc3nc(C)n2n1)CCCC4- InChIKey
LCPGIAFGNMNCJU-UHFFFAOYSA-N- Molecular formula
- C13H14N4S
- Average molar mass
- 258.34 g/mol
- Monoisotopic mass
- 258.09391764
Names & identifiers
- Preferred name
- Cyclopenta[c]fluorene, 2,4-dimethyl-7,8,9,10-tetrahydro-6-thia-1,3,3a,5-tetraaza-
- IUPAC
- 4,7-dimethyl-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene
Names & synonyms
77995-51-8NSC3498402,5-dimethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine2,5-dimethyl-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidineCambridge id 6982087DTXSID00319720LCPGIAFGNMNCJU-UHFFFAOYSA-NSTK720304AKOS001738315NSC-349840Cyclopenta[c]fluorene, 2,4-dimethyl-7,8,9,10-tetrahydro-6-thia-1,3,3a,5-tetraaza-SR-01000248020
Show more names
SR-01000248020-14,7-dimethyl-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene
Database identifiers
- CAS
77995-51-8- PubChem CID
- 336256
- DTXSID
DTXSID00319720
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 71.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 339
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…