Cas no 15093-57-9 (Urea,1-(cyclohexyl-2,2,6,6-d4)-3-phenyl-2-thio- (8CI))
15093-57-9 structure
Product Name:Urea,1-(cyclohexyl-2,2,6,6-d4)-3-phenyl-2-thio- (8CI)
CAS No:15093-57-9
MF:C13H18N2S
MW:234.360421657562
CID:172890
PubChem ID:766306
Update Time:2025-04-19
Urea,1-(cyclohexyl-2,2,6,6-d4)-3-phenyl-2-thio- (8CI) Chemical and Physical Properties
Names and Identifiers
-
- Urea,1-(cyclohexyl-2,2,6,6-d4)-3-phenyl-2-thio- (8CI)
- NSC-48676
- SR-01000395536
- N-Cyclohexyl-N'-phenylthiourea
- Urea, 1-cyclohexyl-3-phenyl-2-thio-
- BDBM50356179
- 1-Cyclohexyl-3-phenyl-2-thiourea
- 1-Cyclohexyl-3-phenyl thiourea
- MFCD00021317
- CS-0322567
- SR-01000395536-1
- Thiourea, N-cyclohexyl-N'-phenyl-
- CHEMBL1910059
- 722-03-2
- 15093-57-9
- AKOS000431373
- 3-cyclohexyl-1-phenylthiourea
- NSC48676
- FS-4154
- F71546
- A837448
- FT-0707225
- SCHEMBL5455050
- N-Cyclohexyl-N'-phenylcarbamimidothioic acid
- DTXSID70934126
- NSC131992
- 1-Cyclohexyl-3-phenylthiourea
- NSC-131992
- 1-Cyclohexyl-3-phenyl-2-thiourea,
-
- Inchi： 1S/C13H18N2S/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1,3-4,7-8,12H,2,5-6,9-10H2,(H2,14,15,16)
- InChI Key： PASBFQMDQRGJBH-UHFFFAOYSA-N
- SMILES： S=C(NC1C=CC=CC=1)NC1CCCCC1
Computed Properties
- Exact Mass: 234.11906976g/mol
- Monoisotopic Mass: 234.11906976g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 218
- 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: 3.5
- Topological Polar Surface Area: 56.2?2
Urea,1-(cyclohexyl-2,2,6,6-d4)-3-phenyl-2-thio- (8CI) Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
-
Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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5. Exclusive enantioselective recognition of glucopyranosides by inherently chiral hemicryptophanes?Olivier Perraud,Alexandre Martinez,Jean-Pierre Dutasta Chem. Commun., 2011,47, 5861-5863
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