N-{5-thia-3-azatetracyclo[6.6.1.0^{2,6}.0^{11,15}]pentadeca-1(15),2(6),3,7,11,13-hexaen-4-yl}naphthalene-1-carboxamide
Basic information
- CAS
6262-41-5- Standard SMILES
O=C(Nc1nc2c(cc3c4c(cccc42)CC3)s1)c1cccc2ccccc12- InChIKey
PFRHTTYWJHKEJT-UHFFFAOYSA-N- Molecular formula
- C24H16N2OS
- Average molar mass
- 380.5 g/mol
- Monoisotopic mass
- 380.09833431
Names & identifiers
- Preferred name
- N-{5-thia-3-azatetracyclo[6.6.1.0^{2,6}.0^{11,15}]pentadeca-1(15),2(6),3,7,11,13-hexaen-4-yl}naphthalene-1-carboxamide
- IUPAC
- N-(5-thia-3-azatetracyclo[6.6.1.02,6.011,15]pentadeca-1(14),2(6),3,7,11(15),12-hexaen-4-yl)naphthalene-1-carboxamide
Names & synonyms
ZINC04176262477325-83-06262-41-5N-{5-thia-3-azatetracyclo[6.6.1.0^{2,6}.0^{11,15}]pentadeca-1(15),2(6),3,7,11,13-hexaen-4-yl}naphthalene-1-carboxamideN-(4,5-dihydroacenaphtho[5,4-d]thiazol-8-yl)-1-naphthamideOprea1_236986DTXSID10412711AKOS024599893AB00672499-01F0779-0441N-(4,5-Dihydroacenaphtho[5,4-d][1,3]thiazol-8-yl)naphthalene-1-carboxamideN-(5-thia-3-azatetracyclo[6.6.1.02,6.011,15]pentadeca-1(14),2(6),3,7,11(15),12-hexaen-4-yl)naphthalene-1-carboxamide
Database identifiers
- CAS
6262-41-5- PubChem CID
- 5243145
- DTXSID
DTXSID10412711
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 611
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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