SKF 81297

HCID 1218CAS 71636-61-8

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기본 정보

표준 SMILES: Oc1cc2c(c(Cl)c1O)CCNCC2c1ccccc1
InChIKey: GHWJEDJMOVUXEC-UHFFFAOYSA-N
분자식: C16H16ClNO2
평균 분자량: 289.762 g/mol
단동위원소 질량: 289.08695643

이름 및 식별자

우선 이름: SKF 81297
IUPAC: 6-Chloro-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol
영어명: (+/-)-6-CHLORO-7,8-DIHYDROXY-1-PHENYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE HYDROBROMIDE
분자식: C16H17BrClNO2
분자량: 370.67

이름 및 동의어

sk&f81297(±)-6-Chloro-PBSKF 81297 hydrobromiSKF 81297 HYDROBROMIDE(+/-)-SKF-81297 HYDROBROMIDE(±)-6-Chloro-PB hydrobromide(+/-)-6-CHLORO-PB HYDROBROMIDE(+-)-6-CHLORO-PB HYDROBROMIDE (+-)-SKF-8 1297, HCL6-Chloro-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol2,3,4,5-Tetrahydro-6-chloro-1-phenyl-1H-3-benzazepine-7,8-diol

데이터베이스 식별자

CAS: 71636-61-8
PubChem CID: 1218
DTXSID: DTXSID3043815
ChEMBL: CHEMBL353335
ChEBI: CHEBI:91517
UNII: 9GBP09E08K
EC Number: 635-324-7
Nikkaji: J245.676A

물성

물리화학적 성질

저장 조건: 4 °C · Desiccate at +4°C
용해도: 2 O: · H2O: 1.7 mg/mL
물리적 상태: 고체
색상: 회색
수용성: 2 O: · H2O: 1.7mg/mLDMSO: >10mg/mLethanol: 6.3mg/mL
InChI: 1S/C16H16ClNO2.BrH/c17-15-11-6-7-18-9-13(10-4-2-1-3-5-10)12(11)8-14(19)16(15)20;/h1-5,8,13,18-20H,6-7,9H2;1H
InChIKey: RMIJGBMRNYUZRG-UHFFFAOYSA-N
SMILES: Br[H].Oc1cc2C(CNCCc2c(Cl)c1O)c3ccccc3

안전 및 규제

안전 데이터

wgk: 3
risk_code: 36/37/38
hazard_code: Xi
safety_code: 22-26-36
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야 · 1건

용도(±)-6-Chloro-PB hydrobromide has been used as a dopamine D1 receptor (Drd1a) agonist to study the role of the drd1a-dopamine receptor inactivation of extracellular signalregulated protein kinase 1/2 (ERK1/2) in the wild-type and striatum of dopamine-depleted mice. It has also been used as a Drd1a agonist to identify the contribution of D1 (D1R)-like dopamine receptor signaling on learning and memory in Barnes maze in rats.