[4-(3-Hydroxyphenyl)-8-(Trifluoromethyl)Quinolin-3-yl](Phenyl)Methanone

HCID 11773771

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: O=C(c1ccccc1)c1cnc2c(C(F)(F)F)cccc2c1-c1cccc(O)c1
InChIKey: KENBGHMSTBKWSA-UHFFFAOYSA-N
분자식: C23H14F3NO2
평균 분자량: 393.4 g/mol

이름 및 식별자

우선 이름: [4-(3-Hydroxyphenyl)-8-(Trifluoromethyl)Quinolin-3-yl](Phenyl)Methanone
IUPAC: [4-(3-hydroxyphenyl)-8-(trifluoromethyl)quinolin-3-yl]-phenylmethanone

이름 및 동의어

[4-(3-Hydroxyphenyl)-8-(Trifluoromethyl)Quinolin-3-yl](Phenyl)MethanoneSCHEMBL1124461[4-(3-hydroxy-phenyl)-8-trifluoromethylquinolin-3-yl]-phenyl methanone[4-(3-hydroxyphenyl)-8-(trifluoromethyl)-quinolin-3-yl](phenyl)methanone

데이터베이스 식별자

PubChem CID: 11773771

물성

구조 계산 물성

XLogP: 5.7
극성 표면적: 50.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 6
회전 가능 결합 수: 3
무거운 원자 수: 29
형식 전하: 0
복잡도: 575

관련 반응

79건

반응 기록 만들기

HRID 95380 반응식

HRID 95380반응물로Training data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 117571 반응식

HRID 117571반응물로Training data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 144486 반응식

HRID 144486반응물로Training data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 172419 반응식

HRID 172419반응물로Training data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 185003 반응식

HRID 185003반응물로Training data from https://doi.org/10.1039/C8SC04228D (6/10)

HRID 193367 반응식

HRID 193367생성물로Training data from https://doi.org/10.1039/C8SC04228D (6/10)

HRID 281952 반응식

HRID 281952반응물로Training data from https://doi.org/10.1039/C8SC04228D (8/10)

HRID 296079 반응식

HRID 296079반응물로Training data from https://doi.org/10.1039/C8SC04228D (8/10)

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