Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HCID 16662425생성일: 2026년 11월 4일
PF-2413873
PF-2413873 · PF-02413873, 10 mM in DMSO · 4-[3-cyclopropyl-5-methyl-1-(methylsulfonylmethyl)pyrazol-4-yl]oxy-2,6-dimethylbenzonitrile · 4-((3-cyclopropyl-5-methyl-1-((methylsulfonyl)methyl)-1H-pyrazol-4-yl)oxy)-2,6-dimethylbenzonitrile · Benzonitrile, 4-[[3-cyclopropyl-5-methyl-1-[(methylsulfonyl)methyl]-1H-pyrazol-4-yl]oxy]-2,6-dimethyl- · nonsteroidal,inhibit,PF 2413873,Progesterone Receptor,endometrial,PF-2413873,nuclear,PF 02413873,NR3C3,PF2413873,PF-02413873,translocation,progesterone,Inhibitor
https://huagongshe.com/ko/chemical/16662425
식별자 및 물리적 특성
| CAS No. | 936345-35-6 |
|---|
| 분자식 | C18H21N3O3S |
|---|
| 평균 분자량 | 359.44 g/mol |
|---|
| SMILES | Cc1cc(Oc2c(C3CC3)nn(CS(C)(=O)=O)c2C)cc(C)c1C#N |
|---|
| InChIKey | QSFGZNVRVZHUGV-UHFFFAOYSA-N |
|---|
| PubChem CID | 16662425 |
|---|
화학 및 물리적 성질
| 녹는점 | 163-164 °C |
|---|
| 끓는 점 | 548.9±50.0 °C(Predicted) |
|---|
| 밀도 | 1.31±0.1 g/cm3(Predicted) |
|---|
| 저장 조건 | room temp |
|---|
| 용해도 | DMSO : 100 mg/mL (278.21 mMNeed ultrasonic) |
|---|
| pKa(산도 계수) | 1.12±0.10(Predicted) |
|---|
| 물리적 상태 | Solid |
|---|
| 색상 | White to light yellow |
|---|
| InChI | 1S/C18H21N3O3S/c1-11-7-15(8-12(2)16(11)9-19)24-18-13(3)21(10-25(4,22)23)20-17(18)14-5-6-14/h7-8,14H,5-6,10H2,1-4H3 |
|---|
| InChIKey | QSFGZNVRVZHUGV-UHFFFAOYSA-N |
|---|
| SMILES | CC1=C(C#N)C(C)=CC(OC2=C(C)N(CS(=O)(C)=O)N=C2C3CC3)=C1 |
|---|
안전 및 규제
| 수질 위해 등급(WGK) | WGK 3 |
|---|
| 저장 분류 | 11 - Combustible Solids |
|---|
