| CAS Number | 1092460-38-2 |
| Catalog Number | AG00HBCJ |
| Chemical Name | 1-(2-AMINOETHYL)-3-(4-TERT-BUTYLTHIAZOL-2-YL)UREA |
| IUPAC Name | 1-(2-aminoethyl)-3-(4-tert-butyl-1,3-thiazol-2-yl)urea |
| InChI | InChI=1S/C10H18N4OS/c1-10(2,3)7-6-16-9(13-7)14-8(15)12-5-4-11/h6H,4-5,11H2,1-3H3,(H2,12,13,14,15) |
| InChI Key | RKBQBJOJODKKPJ-UHFFFAOYSA-N |
| MDL Number | MFCD11501880 |
| Molecular Formula | C10H18N4OS |
| Molecular Weight | 242.3411 |
| SMILES | CC(C)(C)C1=CSC(NC(=O)NCCN)=N1 |
| Synonyms | 1-(2-AMINOETHYL)-3-(4-TERT-BUTYLTHIAZOL-2-YL)UREA,
1092460-38-2,
1-(2-Aminoethyl)-3-(4-(tert-butyl)thiazol-2-yl)urea,
AR2282,
MFCD11501880,
ZINC35287389,
AKOS026798526,
AS-45316,
|
| Complexity | 242 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.12g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.341g/mol |
| Monoisotopic Mass | 242.12g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 108A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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