2-(4-{9-oxo-1,3,10-triazatricyclo[6.4.1.0⁴,¹³]trideca-2,4,6,8(13)-tetraen-2-yl}phenoxy)ethyl 4-methylbenzene-1-sulfonate
Structure Info
- Chemspace ID
- CSSB20620705080 (In-Stock Building Blocks)
- IUPAC Name
- 2-(4-{9-oxo-1,3,10-triazatricyclo[6.4.1.0⁴,¹³]trideca-2,4,6,8(13)-tetraen-2-yl}phenoxy)ethyl 4-methylbenzene-1-sulfonate
- Mol formula
- C25H23N3O5S
- Mol weight
- 478 Da
- Catalog Number(s)
- AA0F1DAJ, AG0F1DDB, BD02802415, HY-402634, JS58023, ST0F1EU3, TX0F1EIZ
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.13
- Heavy atoms count
- 34
- Rotatable bond count
- 7
- Number of rings
- 5
- Carbon bond saturation, Fsp3
- 0.2
- Polar surface area (Å)
- 100
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
![Chemical structure of 2-(4-{9-oxo-1,3,10-triazatricyclo[6.4.1.0⁴,¹³]trideca-2,4,6,8(13)-tetraen-2-yl}phenoxy)ethyl 4-methylbenzene-1-sulfonate (C25H23N3O5S) - CSSB20620705080](/st/structure/200/35d740e96a1bacaf14ab658b240a8e42/CC1%253DCC%253DC%2528C%253DC1%2529S%2528%253DO%2529%2528%253DO%2529OCCOC1%253DCC%253DC%2528C%253DC1%2529C1%253DNC2%253DCC%253DCC3%253DC2N1CCNC3%253DO.png "C25H23N3O5S")
- Zoom the structure
- CSSB20620705080
Items Overall 3 items from 3 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| 1st Scientific LLC | 7 days | United States To: | 98 | 1 mg | 309.10 | |
Description: 2-(4-(6-Oxo-6,7,8,9-tetrahydro-2,7,9a-triazabenzo[cd]azulen-1-yl)phenoxy)ethyl 4-methylbenzenesulfonate; CAS: 2107319-08-2 | ||||||
| A2B Chem | 12 days | United States To: | 98 | 1 mg | 358.80 | |
Description: 2-(4-(6-Oxo-6,7,8,9-tetrahydro-2,7,9a-triazabenzo[cd]azulen-1-yl)phenoxy)ethyl 4-methylbenzenesulfonate; CAS: 2107319-08-2 | ||||||
| 10X CHEM | TBD | United States To: | 98 | 1 mg | 316.80 | |
Description: 2-(4-(6-Oxo-6,7,8,9-tetrahydro-2,7,9a-triazabenzo[cd]azulen-1-yl)phenoxy)ethyl 4-methylbenzenesulfonate; CAS: 2107319-08-2 | ||||||
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