2-[(2Z)-5-bromo-2-[(23-{[(2Z)-5-bromo-1-(dicyanomethylidene)-3-oxo-2,3-dihydro-1H-inden-2-ylidene]methyl}-3,27-bis(2-decyltetradecyl)-15-methyl-8,22-diundecyl-6,10,20,24-tetrathia-3,14,15,16,27-pentaazaoctacyclo[16.9.0.0²,¹².0⁴,¹¹.0⁵,⁹.0¹³,¹⁷.0¹⁹,²⁶.0²¹,²⁵]heptacosa-1(18),2(12),4(11),5(9),7,13,16,19(26),21(25),22-decaen-7-yl)methylidene]-3-oxo-2,3-dihydro-1H-inden-1-ylidene]propanedinitrile
Structure Info
- Chemspace ID
- CSSB14855344572 (In-Stock Building Blocks)
- IUPAC Name
- 2-[(2Z)-5-bromo-2-[(23-{[(2Z)-5-bromo-1-(dicyanomethylidene)-3-oxo-2,3-dihydro-1H-inden-2-ylidene]methyl}-3,27-bis(2-decyltetradecyl)-15-methyl-8,22-diundecyl-6,10,20,24-tetrathia-3,14,15,16,27-pentaazaoctacyclo[16.9.0.0²,¹².0⁴,¹¹.0⁵,⁹.0¹³,¹⁷.0¹⁹,²⁶.0²¹,²⁵]heptacosa-1(18),2(12),4(11),5(9),7,13,16,19(26),21(25),22-decaen-7-yl)methylidene]-3-oxo-2,3-dihydro-1H-inden-1-ylidene]propanedinitrile
- Mol formula
- C115H155Br2N9O2S4
- Mol weight
- 1984 Da
- Catalog Number(s)
- ADB4122255001, CS-0617044, F84774, F988809, TX029J9U, X211815, Y4182483
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 40.82
- Heavy atoms count
- 132
- Rotatable bond count
- 66
- Number of rings
- 12
- Carbon bond saturation, Fsp3
- 0.617
- Polar surface area (Å)
- 170
- Hydrogen bond acceptors count
- 8
- Hydrogen bond donors count
- 0
![Chemical structure of 2-[(2Z)-5-bromo-2-[(23-{[(2Z)-5-bromo-1-(dicyanomethylidene)-3-oxo-2,3-dihydro-1H-inden-2-ylidene]methyl}-3,27-bis(2-decyltetradecyl)-15-methyl-8,22-diundecyl-6,10,20,24-tetrathia-3,14,15,16,27-pentaazaoctacyclo[16.9.0.0²,¹².0⁴,¹¹.0⁵,⁹.0¹³,¹⁷.0¹⁹,²⁶.0²¹,²⁵]heptacosa-1(18),2(12),4(11),5(9),7,13,16,19(26),21(25),22-decaen-7-yl)methylidene]-3-oxo-2,3-dihydro-1H-inden-1-ylidene]propanedinitrile (C115H155Br2N9O2S4) - CSSB14855344572](/st/structure/200/00af97d3e2f9f68f9830138ed0ca1ec7/CCCCCCCCCCCCC%2528CCCCCCCCCC%2529Cn1c2c3sc%2528%255CC%253DC4%252FC%2528%253DO%2529c5cc%2528Br%2529ccc5C4%253DC%2528C%2523N%2529C%2523N%2529c%2528CCCCCCCCCCC%2529c3sc2c2c3nn%2528C%2529nc3c3c4sc5c%2528CCCCCCCCCCC%2529c%2528%255CC%253DC6%252FC%2528%253DO%2529c7cc%2528Br%2529ccc7C6%253DC%2528C%2523N%2529C%2523N%2529sc5c4n%2528CC%2528CCCCCCCCCC%2529CCCCCCCCCCCC%2529c3c12.png "C115H155Br2N9O2S4")
- Zoom the structure
- CSSB14855344572
Items Overall 2 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Advanced ChemBlocks CN | 10 days | China To: | 98 | 25 mg | 495.00 | |
| Advanced ChemBlocks CN | 10 days | China To: | 98 | 100 mg | 1,485.00 | |
Description: 2,2'-(((12,13-bis(2-decyltetradecyl)-6-methyl-3,9-diundecyl-12,13-dihydro-6H-thieno[2'',3'':4',5']thieno[2',3':4,5]pyrrolo[3,2-g]thieno[2',3':4,5]thieno[3,2-b][1,2,3]triazolo[4,5-e]indole-2,10-diyl)bis(methaneylylidene))bis(5-bromo-3-oxo-2,3-dihydro-1H-indene-2,1-diylidene))dimalononitrile; CAS: 2761541-59-5 | ||||||
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