(2S)-2-(8-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-Pyrrolidinecarboxylic acid phenylmethyl ester
한글명:(2S)-2-(8-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-Pyrrolidinecarboxylic acid phenylmethyl ester
카스 번호1420478-88-1
상품명:(2S)-2-(8-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)-1-Pyrrolidinecarboxylic acid phenylmethyl ester
CBNumberCB53062794
분자식C18H18BrN5O2
포뮬러 무게416.27
MOL 파일1420478-88-1.mol
화학적 성질
밀도 | 1?+-.0.1 g/cm3(Predicted) |
저장 조건 | under inert gas (nitrogen or Argon) at 2-8°C |
산도 계수 (pKa) | 4.67±0.30(Predicted) |
InChI | InChI=1S/C18H18BrN5O2/c19-15-14-16(20)21-8-10-24(14)17(22-15)13-7-4-9-23(13)18(25)26-11-12-5-2-1-3-6-12/h1-3,5-6,8,10,13H,4,7,9,11H2,(H2,20,21)/t13-/m0/s1 |
InChIKey | DLXYYJDQLZHBNU-ZDUSSCGKSA-N |
SMILES | N1(C(OCC2=CC=CC=C2)=O)CCC[C@H]1C1N2C=CN=C(N)C2=C(Br)N=1 |