Cas no 67021-62-9 (Urea, N-(2-methylphenyl)-N'-1,2,3-thiadiazol-5-yl-)
67021-62-9 structure
Product Name:Urea, N-(2-methylphenyl)-N'-1,2,3-thiadiazol-5-yl-
CAS No:67021-62-9
MF:C10H10N4OS
MW:234.277599811554
CID:395461
PubChem ID:13729985
Update Time:2025-04-19
Urea, N-(2-methylphenyl)-N'-1,2,3-thiadiazol-5-yl- Chemical and Physical Properties
Names and Identifiers
-
- Urea, N-(2-methylphenyl)-N'-1,2,3-thiadiazol-5-yl-
- 1-(2-methylphenyl)-3-(thiadiazol-5-yl)urea
- SCHEMBL8378501
- DTXSID80547822
- 67021-62-9
- N-(2-Methylphenyl)-N'-1,2,3-thiadiazol-5-ylurea
-
- Inchi： 1S/C10H10N4OS/c1-7-4-2-3-5-8(7)12-10(15)13-9-6-11-14-16-9/h2-6H,1H3,(H2,12,13,15)
- InChI Key： RPOZCTAHYSTBLD-UHFFFAOYSA-N
- SMILES： S1C(=CN=N1)NC(NC1C=CC=CC=1C)=O
Computed Properties
- Exact Mass: 234.0577
- Monoisotopic Mass: 234.05753213g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 251
- 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: 1.7
- Topological Polar Surface Area: 95.2?2
Experimental Properties
- PSA: 66.91
Urea, N-(2-methylphenyl)-N'-1,2,3-thiadiazol-5-yl- Related Literature
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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