Cas no 171179-73-0 (6-Benzothiazolecarboxamide,5-amino-)
171179-73-0 structure
Product Name:6-Benzothiazolecarboxamide,5-amino-
CAS No:171179-73-0
MF:C8H7N3OS
MW:193.225679636002
CID:111389
PubChem ID:18184425
Update Time:2025-04-18
6-Benzothiazolecarboxamide,5-amino- Chemical and Physical Properties
Names and Identifiers
-
- 6-Benzothiazolecarboxamide,5-amino-
- 6-Benzothiazolecarboxamide,5-amino-(9CI)
- 171179-73-0
- 5-aminobenzothiazole-6-carboxamide
- REYLWTJXMPVPJM-UHFFFAOYSA-N
- SCHEMBL7218081
- 5-amino-1,3-benzothiazole-6-carboxamide
-
- Inchi: 1S/C8H7N3OS/c9-5-2-6-7(13-3-11-6)1-4(5)8(10)12/h1-3H,9H2,(H2,10,12)
- InChI Key: REYLWTJXMPVPJM-UHFFFAOYSA-N
- SMILES: S1C=NC2C=C(C(C(N)=O)=CC1=2)N
Computed Properties
- Exact Mass: 193.03098303g/mol
- Monoisotopic Mass: 193.03098303g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 223
- 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
- XLogP3: 1.1
- Topological Polar Surface Area: 110?2
6-Benzothiazolecarboxamide,5-amino- Related Literature
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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