Primary record
BMS-911543
- CAS
- 1271022-90-2
- PubChem CID
- 137179498
- SMILES
- CCN1C(=CC2=C3C(=C(N=C21)/N=C\4/CC(=NN4)C)N=CN3C)C(=O)N(C5CC5)C6CC6
- Molecular Formula
- C22H26N8O
- Molecular Weight
- 418.505
- Exact Mass
- 418.223
- InChI
- InChI=1S/C22H26N8O/c1-4-29-16(22(31)30(13-5-6-13)14-7-8-14)10-15-19-18(23-11-28(19)3)20(25-21(15)29)24-17-9-12(2)26-27-17/h10-11,13-14H,4-9H2,1-3H3,(H,24,25,27)
- InChIKey
- CDJFBTDEUDPWRO-UHFFFAOYSA-N
- LogP
- 3.1091
- TPSA
- 92.7
Names and synonyms
- BMS-911543
- 1271022-90-2