| Identification | Back Directory | [Name]
Spiro[cyclohexane-1,9'(6'H)-pyrazino[1',2':1,5]pyrrolo[2,3-d]pyrimidine]-7'(8'H)-carboxylic acid, 2'-(methylthio)-6'-oxo-, 1,1-dimethylethyl ester | [CAS]
2170746-99-1 | [Synonyms]
Trilaciclib Impurity 9
Trilaciclib Impurity 10
Spiro[cyclohexane-1,9'(6'H)-pyrazino[1',2':1,5]pyrrolo[2,3-d]pyrimidine]-7'(8'H)-carboxylic acid, 2'-(methylthio)-6'-oxo-, 1,1-dimethylethyl ester | [Molecular Formula]
C20H26N4O3S | [MOL File]
2170746-99-1.mol | [Molecular Weight]
402.51 |
| Chemical Properties | Back Directory | [Boiling point ]
591.6±60.0 °C(Predicted) | [density ]
1.36±0.1 g/cm3(Predicted) | [pka]
3.62±0.20(Predicted) | [InChI]
InChI=1S/C20H26N4O3S/c1-19(2,3)27-18(26)23-12-20(8-6-5-7-9-20)24-14(16(23)25)10-13-11-21-17(28-4)22-15(13)24/h10-11H,5-9,12H2,1-4H3 | [InChIKey]
ZNXCPAMKLRICKH-UHFFFAOYSA-N | [SMILES]
C12(CN(C(OC(C)(C)C)=O)C(=O)C3N1C1C(C=3)=CN=C(SC)N=1)CCCCC2 |
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