Cas no 35317-91-0 (Thiazolo[5,4-h]isoquinoline-2,5-diamine)
35317-91-0 structure
Product Name:Thiazolo[5,4-h]isoquinoline-2,5-diamine
CAS No:35317-91-0
MF:C10H8N4S
MW:216.262319564819
CID:295568
PubChem ID:45077607
Update Time:2025-04-19
Thiazolo[5,4-h]isoquinoline-2,5-diamine Chemical and Physical Properties
Names and Identifiers
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- Thiazolo[5,4-h]isoquinoline-2,5-diamine
- Thiazolo[5,4-h]isoquinoline-2,5-diamine (9CI)
- [1,3]thiazolo[5,4-h]isoquinoline-2,5-diamine
- 35317-91-0
- Thiazolo[5,4-h]isoquinoline-2,5-diamine(9ci)
- DTXSID10663342
-
- Inchi: 1S/C10H8N4S/c11-7-3-8-9(14-10(12)15-8)6-4-13-2-1-5(6)7/h1-4H,11H2,(H2,12,14)
- InChI Key: IQLYCMQTKMFFBP-UHFFFAOYSA-N
- SMILES: S1C(N)=NC2=C1C=C(C1C=CN=CC=12)N
Computed Properties
- Exact Mass: 216.04714
- Monoisotopic Mass: 216.047
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 0
- Complexity: 250
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 106A^2
- XLogP3: 1.5
Experimental Properties
- PSA: 77.82
Thiazolo[5,4-h]isoquinoline-2,5-diamine Related Literature
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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5. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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