| CAS Number | 1437794-63-2 |
| Catalog Number | AG00AQIX(AGN-PC-0WA43E) |
| Chemical Name | 1,3-Bis(2,3,4,9-tetrahydro-1H-carbazol-3-yl)urea |
| IUPAC Name | 1,3-bis(2,3,4,9-tetrahydro-1H-carbazol-3-yl)urea |
| InChI | InChI=1S/C25H26N4O/c30-25(26-15-9-11-23-19(13-15)17-5-1-3-7-21(17)28-23)27-16-10-12-24-20(14-16)18-6-2-4-8-22(18)29-24/h1-8,15-16,28-29H,9-14H2,(H2,26,27,30) |
| InChI Key | ZEUODYSFUDUYRE-UHFFFAOYSA-N |
| MDL Number | MFCD24448804 |
| Molecular Formula | C25H26N4O |
| Molecular Weight | 398.5001 |
| SMILES | O=C(NC1CCc2c(C1)c1ccccc1[nH]2)NC1CCc2c(C1)c1ccccc1[nH]2 |
| Synonyms | 1,3-Bis(2,3,4,9-tetrahydro-1H-carbazol-3-yl)urea,
1437794-63-2,
C25H26N4O,
V3279,
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| Complexity | 589 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 398.211g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 30 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 398.51g/mol |
| Monoisotopic Mass | 398.211g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 72.7A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.5 |
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Certificate of Analysis
Lot Number