기본 정보
- CAS
40714-43-0- 표준 SMILES
CCN(CC)CCC1(c2ccccc2)C(=O)N(N(C)Cc2cccc(OC)c2OC)c2ccccc21- InChIKey
QAHNYLOWHSOTJP-UHFFFAOYSA-N- 분자식
- C30H37N3O3
- 평균 분자량
- 487.6 g/mol
- 단동위원소 질량
- 487.28349205
이름 및 식별자
- 우선 이름
- 2-Indolinone, 3-(2-(diethylamino)ethyl)-1-((2,3-dimethoxybenzyl)methylamino)-3-phenyl-
- IUPAC
- 3-[2-(diethylamino)ethyl]-1-[(2,3-dimethoxyphenyl)methyl-methylamino]-3-phenylindol-2-one
- 영어명
- 3-(2-Diethylaminoethyl)-1-[(2,3-dimethoxybenzyl)methylamino]-3-phenyl-2-indolinone
- 분자식
- C30H37N3O3
- 분자량
- 487.63
이름 및 동의어
40714-43-0BRN 04658542-Indolinone, 3-(2-(diethylamino)ethyl)-1-((2,3-dimethoxybenzyl)methylamino)-3-phenyl-3-(2-(Diethylamino)ethyl)-1-((2,3-dimethoxybenzyl)methylamino)-3-phenyl-2-indolinoneDTXSID609611283-(2-Diethylaminoethyl)-1-[(2,3-dimethoxybenzyl)methylamino]-3-phenyl-2-indolinone3-[2-(diethylamino)ethyl]-1-[(2,3-dimethoxybenzyl)(methyl)amino]-3-phenyl-1,3-dihydro-2H-indol-2-one3-[2-(Diethylamino)ethyl]-1-{[(2,3-dimethoxyphenyl)methyl](methyl)amino}-3-phenyl-1,3-dihydro-2H-indol-2-one3-(2-diethylamino-ethyl)-1-[(2,3-dimethoxy-benzyl)-methyl-amino]-3-phenyl-1,3-dihydro-indol-2-one2H-Indol-2-one, 3-[2-(diethylamino)ethyl]-1-[[(2,3-dimethoxyphenyl)methyl]methylamino]-1,3-dihydro-3-phenyl-
데이터베이스 식별자
- CAS
40714-43-0- PubChem CID
- 38642
- DTXSID
DTXSID60961128- Nikkaji
- J68.739A
물성
구조 계산 물성
- XLogP
- 5.3
- 극성 표면적
- 45.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 36
- 형식 전하
- 0
- 복잡도
- 695
물리화학적 성질
- 끓는 점
- 584.2 · 584.2±60.0 °C(Predicted)
- 밀도
- 1.18 · 1.18±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 10.17 · 10.17±0.25(Predicted)
관련 반응
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