VZJFCZLCVJXDGY-UHFFFAOYSA-N
C24H26F3N7O2 — CID 155730017
Data last refreshed: (MolForge compound catalog, from PubChem)
About VZJFCZLCVJXDGY-UHFFFAOYSA-N
VZJFCZLCVJXDGY-UHFFFAOYSA-N (PubChem CID 155730017) has the molecular formula C24H26F3N7O2 and a molecular weight of 501.51 g/mol. Its IUPAC name is 1-[[5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]methyl]-6-fluoro-3-methyl-5-(4-propan-2-ylpiperazin-1-yl)benzimidazol-2-one.
Molecular Properties
| Compound Name | VZJFCZLCVJXDGY-UHFFFAOYSA-N |
|---|---|
| PubChem CID | 155730017 |
| Molecular Formula | C24H26F3N7O2 |
| Molecular Weight | 501.51 g/mol |
| Exact Mass | 501.21 |
| IUPAC Name | 1-[[5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]methyl]-6-fluoro-3-methyl-5-(4-propan-2-ylpiperazin-1-yl)benzimidazol-2-one |
| SMILES | CC(C)N1CCN(c2cc3c(cc2F)n(Cc2ccc(-c4nnc(C(F)F)o4)cn2)c(=O)n3C)CC1 |
| InChI | InChI=1S/C24H26F3N7O2/c1-14(2)32-6-8-33(9-7-32)18-11-19-20(10-17(18)25)34(24(35)31(19)3)13-16-5-4-15(12-28-16)22-29-30-23(36-22)21(26)27/h4-5,10-12,14,21H,6-9,13H2,1-3H3 |
| InChIKey | VZJFCZLCVJXDGY-UHFFFAOYSA-N |
| XLogP | 3.44 |
| TPSA | 85.22 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 36 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
|---|---|
| MW ≤ 500 | 501.51 |
| LogP ≤ 5 | 3.44 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 9 |
Frequently Asked Questions
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Sources
- PubChem CID 155730017 — identifiers, structure, computed properties (public domain)
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