Cas no 5652-41-5 (1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo- (9CI))
![1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo- (9CI) structure](https://ossimg.kuujia.com/scimg/6000/5652-41-5x500.png)
5652-41-5 structure
Product Name:1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo- (9CI)
CAS No:5652-41-5
MF:C10H16N2O3S
MW:244.310641288757
CID:381982
PubChem ID:6604653
Update Time:2025-04-19
1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo- (9CI)
- Allobiotin(8CI)
- NCGC00017315-01
- Allobiotin, DL-
- UNII-6L08Y4AOXW
- 1H-Thieno(3,4-d)imidazole-4-pentanoic acid, hexahydro-2-oxo-
- D-Biotin ,(S)
- Q27166494
- 5-(2-Oxo-1,3,3a,4,6,6a-hexahydrothieno(3,4-d)imidazol-4-yl)pentanoic acid
- 5-[(3aS,4S,6aS)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acid
- Allobiotin
- TNP00247
- 6L08Y4AOXW
- CHEMBL1315356
- CHEBI:94689
- BRD-K63899271-001-01-4
- SCHEMBL20547409
- 5652-41-5
-
- Inchi： 1S/C10H16N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7+,9+/m1/s1
- InChI Key： YBJHBAHKTGYVGT-FJXKBIBVSA-N
- SMILES： S1C[C@@H]2[C@@H]([C@@H]1CCCCC(=O)O)NC(N2)=O
Computed Properties
- Exact Mass: 244.08828
- Monoisotopic Mass: 244.08816355g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- Complexity: 298
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 3
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.3
- Topological Polar Surface Area: 104?2
Experimental Properties
- PSA: 78.43
1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo- (9CI) Related Literature
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
-
Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
-
R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
5652-41-5 (1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo- (9CI)) Related Products
- 58-85-5(D-Biotin)
- 22879-79-4(VITAMIN H)
- 415725-35-8(9-Methyl Biotin (mixture of diastereomers))
- 1217850-77-5(rac Biotin-d4)
- 608-16-2((+)-Biotin Methyl Ester)
- 1405-69-2(Avidin)
- 60562-11-0(1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo-, methyl ester, (3aR,4R,6aS)-rel-)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
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