Imnopitant

HCID 9808518

데이터를 보충하는 중입니다. 보통 1분 이내에 완료됩니다

기본 정보

CAS
290297-57-3
표준 SMILES
Cc1ccccc1-c1cc(N2CCN(C)CC2)ncc1C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1
InChIKey
HCNNJLLLMSVTFH-UHFFFAOYSA-N
분자식
C28H28F6N4O
평균 분자량
550.5 g/mol

개요

Imnopitant is a small molecule drug. The usage of the INN stem '-pitant' in the name indicates that Imnopitant is a neurokinin NK1​ (substance P) receptor antagonist. Imnopitant has a monoisotopic molecular weight of 550.22 Da.

이름 및 식별자

우선 이름
Imnopitant
IUPAC
N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-methyl-4-(2-methylphenyl)-6-(4-methylpiperazin-1-yl)pyridine-3-carboxamide

이름 및 동의어

Imnopitant290297-57-3Imnopitant [INN]F1516R3E77UNII-F1516R3E77N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-methyl-4-(2-methylphenyl)-6-(4-methylpiperazin-1-yl)pyridine-3-carboxamidecompound 20 [PMID: 16332435]compound 20 (PMID: 16332435)N-{[3,5-bis(trifluoromethyl)phenyl]methyl}-N-methyl-4-(2-methylphenyl)-6-(4-methylpiperazin-1-yl)pyridine-3-carboxamideN-((3,5-bis(trifluoromethyl)phenyl)methyl)-N-methyl-4-(2-methylphenyl)-6-(4-methylpiperazin-1-yl)pyridine-3-carboxamideRefChem:148035CHEMBL206488
이름 더 보기
SCHEMBL905330orb1685288SCHEMBL29467378GTPL10462BDBM50178565AKOS040759835DA-74459HY-109147

데이터베이스 식별자

CAS
290297-57-3
PubChem CID
9808518
ChEMBL
CHEMBL206488
UNII
F1516R3E77

물성

구조 계산 물성보충 중

XLogP
5.8
극성 표면적
39.7 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
10
회전 가능 결합 수
5
무거운 원자 수
39

화학 및 산업

공급사4 곳

BOC Sciences1-631-485-4226; 16314854226 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国(陶术生物)15002134094 · [email protected]
济南九黎生物科技有限公司15865264761 · [email protected]

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