기본 정보
- CAS
885704-21-2- 표준 SMILES
CC1CCN(c2cc(N3CCN(C)CC3)ccc2NC(=O)c2cc(C#N)c[nH]2)CC1- InChIKey
DXPSQKSTVIVZLV-UHFFFAOYSA-N- 분자식
- C23H30N6O
- 평균 분자량
- 406.5 g/mol
- 단동위원소 질량
- 406.24810958
개요
4-cyano-N-[4-(4-methyl-1-piperazinyl)-2-(4-methyl-1-piperidinyl)phenyl]-1H-pyrrole-2-carboxamide is an aromatic amide.
이름 및 식별자
- 우선 이름
- c-FMS inhibitor
- IUPAC
- 4-cyano-N-[4-(4-methylpiperazin-1-yl)-2-(4-methylpiperidin-1-yl)phenyl]-1H-pyrrole-2-carboxamide
- 영어명
- 4-Cyano-N-[4-(4-methyl-1-piperazinyl)-2-(4-methyl-1-piperidinyl)phenyl]-1H-pyrrole-2-carboxamide
- 분자식
- C23H30N6O
- 분자량
- 406.52
이름 및 동의어
c-FMS inhibitor885704-21-2c-Fms-IN-3C23H30N6O4-Cyano-N-[4-(4-methyl-1-piperazinyl)-2-(4-methyl-1-piperidinyl)phenyl]-1H-pyrrole-2-carboxamide4-cyano-N-[4-(4-methylpiperazin-1-yl)-2-(4-methylpiperidin-1-yl)phenyl]-1H-pyrrole-2-carboxamide4-cyano-N-(4-(4-methylpiperazin-1-yl)-2-(4-methylpiperidin-1-yl)phenyl)-1H-pyrrole-2-carboxamideCHEMBL254702CID 116543784-Cyano-1H-pyrrole-2-carboxylic acid [4-(4-methyl-piperazin-1-yl)-2-(4-methyl-piperidin-1-yl)-phenyl]-amidearylamide, 84406AC
이름 더 보기
c-FMS-IN-8c Fms IN 3,cFmsIN3c-Fms-IN-3, 10 mM in DMSO4-cyano-N-[4-(4-methyl-1-piperazinyl)-2-(4-methyl-1-piperidinyl)phenyl]-1H-Pyrrole-2-carboxaMide, 4-cyano-N-[4-(4-Methyl-1-piperazinyl)-2-(4-Methyl-1-piperidinyl)phenyl]-c-FMS-IN-8 (1H-Pyrrole-2-carboxamide, 4-cyano-N-[4-(4-methyl-1-piperazinyl)-2-(4-methyl-1-piperidinyl)phenyl]-)
FMS inhibitor compound 8FMS inhibitor compound 1bc-FMS-IN-8?MLS006010297orb1710179SCHEMBL13405731SCHEMBL31157969BDBM27917
물성
구조 계산 물성
- XLogP
- 2.9
- 극성 표면적
- 78.4 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 30
- 형식 전하
- 0
- 복잡도
- 631
물리화학적 성질
- 끓는 점
- 582.7 · 582.7±50.0 °C(Predicted)
- 밀도
- 1.26 · 1.26
- 저장 조건
- -20 °C · Store at -20°C
- 용해도
- 25 mg/mL · DMSO : 25 mg/mL (61.50 mM; Need ultrasonic)H2O : < 0.1 mg/mL (insoluble)
- 물리적 상태
- 가루
- 산도 계수 (pKa)
- 12.96 · 12.96±0.50(Predicted)
- 색상
- White to gray
화학 및 산업
공급사27 곳
Aladdin Scientific[email protected]
銳迪國際科技有限公司18024082417 · [email protected]
北京博奥森生物技术有限公司400-901-9800 18611424007 · [email protected]
学研惠（武汉）科技有限公司15727060112 · [email protected]
AdooQ BioScience, LLC+1 (866) 930-6790 · [email protected]
Wuhan NCE Biomedical Co.,Ltd.4000-027-021 |24 +86-13986109188 | +86-15623472865 | +81-08033611988
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
斯派螺（武汉）药物研发有限公司[email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
广州市齐云生物技术有限公司020-61288194 61288195 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
上海超岚化工科技中心QQ：65489617 13301690235 · [email protected]
菏泽开发区创蠡化工科技有限公司0530-+86-530-529 6766，+86-15666160102 15666160102 · [email protected]
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