4-[4-(azetidine-1-carbonyl)-3-fluorophenoxy]-2,2-dimethyl-N-(1-methylpyrazol-3-yl)-3H-1-benzofuran-6-carboxamide

HCID 24768019
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기본 정보

CAS
955881-01-3
표준 SMILES
Cn1ccc(NC(=O)c2cc(Oc3ccc(C(=O)N4CCC4)c(F)c3)c3c(c2)OC(C)(C)C3)n1
InChIKey
MDMLUBFZTGYEGP-UHFFFAOYSA-N
분자식
C25H25FN4O4
평균 분자량
464.5 g/mol

이름 및 식별자

우선 이름
4-[4-(azetidine-1-carbonyl)-3-fluorophenoxy]-2,2-dimethyl-N-(1-methylpyrazol-3-yl)-3H-1-benzofuran-6-carboxamide
IUPAC
4-[4-(azetidine-1-carbonyl)-3-fluorophenoxy]-2,2-dimethyl-N-(1-methylpyrazol-3-yl)-3H-1-benzofuran-6-carboxamide

이름 및 동의어

PF-04279405955881-01-34-[4-(azetidine-1-carbonyl)-3-fluorophenoxy]-2,2-dimethyl-N-(1-methylpyrazol-3-yl)-3H-1-benzofuran-6-carboxamideSCHEMBL642833orb1741237CHEMBL3218477MDMLUBFZTGYEGP-UHFFFAOYSA-NFNB88101EX-A13855EBC-500076NCGC00485403-014-[4-(1-Azetidinylcarbonyl)-3-fluorophenoxy]-2,3-dihydro-2,2-dimethyl-N-(1-methyl-1H-pyrazol-3-yl)-6-benzofurancarboxamide
이름 더 보기
HY-136631CS-0132720T682444-[4-(azetidine-1-carbonyl)-3-fluoro-phenoxy]-2,2-dimethyl-2,3-dihydro-benzofuran-6-carboxylic acid (1-methyl-1H-pyrazol-3-yl)-amide4-[4-(azetidine-1-carbonyl)-3-fluoro-phenoxy]-2,2-dimethyl-2,3-dihydro-benzofuran-6-carboxylic acid(1-methyl-1H-pyrazol-3-yl)-amide

데이터베이스 식별자

CAS
955881-01-3
PubChem CID
24768019
ChEMBL
CHEMBL3218477
EC Number
809-763-1

물성

구조 계산 물성보충 중

XLogP
3.2
극성 표면적
85.7 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
6
회전 가능 결합 수
5
무거운 원자 수
34

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

화학 및 산업

공급사3 곳

上海美洛英特化学有限公司15821661757 · [email protected]
北京百奥创新科技有限公司15522676233 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]

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