기본 정보
- CAS
159634-47-6- 표준 SMILES
CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC2(CC1)CN(S(C)(=O)=O)c1ccccc12- InChIKey
UMUPQWIGCOZEOY-JOCHJYFZSA-N- 분자식
- C27H36N4O5S
- 평균 분자량
- 528.7 g/mol
- 단동위원소 질량
- 528.24064144
개요
Ibutamoren is an orally bioavailable, small molecule, non-peptide growth hormone secretagogue (GHS). Upon administration, ibutamoren promotes the release of growth hormone (GH) from the pituitary gland, thereby increasing plasma GH levels. This may counteract GH deficiency. GH plays an important role in many biological processes.
이름 및 식별자
- 우선 이름
- Ibutamoren
- IUPAC
- 2-amino-2-methyl-N-[(2R)-1-(1-methylsulfonylspiro[2H-indole-3,4'-piperidine]-1'-yl)-1-oxo-3-phenylmethoxypropan-2-yl]propanamide
- 현지명
- 이부타렌
- 영어명
- MK-677
- 분자식
- C27H36N4O5S
- 분자량
- 528.66
이름 및 동의어
Ibutamoren159634-47-6ibutamorenoGJ0EGN38ULL 1631912-amino-2-methyl-N-[(2R)-1-(1-methylsulfonylspiro[2H-indole-3,4'-piperidine]-1'-yl)-1-oxo-3-phenylmethoxypropan-2-yl]propanamideL-163,191DTXSID901667002-AMINO-N-((R)-2-(BENZYLOXY)-1-((1-(METHYLSULFONYL)SPIRO(INDOLINE-3,4'-PIPERIDIN)-1'-YL)CARBONYL)ETHYL)-2-METHYLPROPIONAMIDE2-AMINO-N-(3-(BENZYLOXY)-1-(1-METHANESULFONYL-1,2-DIHYDROSPIRO(INDOLE-3,4'-PIPERIDIN)-1'-YL)-1-OXOPROPAN-2-YL)-2-METHYLPROPANAMIDEibutamorenum2-amino-2-methyl-N-((2R)-1-(1-methylsulfonylspiro(2H-indole-3,4'-piperidine)-1'-yl)-1-oxo-3-phenylmethoxypropan-2-yl)propanamide
이름 더 보기
이부타렌IbutaMoren (MK-677)MK-677Mk677 SarmsMK-0677MK-677Ibutamoren, 10 mM in DMSOIBUTAMOREN (MK-677), CID178024MK-677?/?Ibutamoren 10mg TabletsIbutamoren,MK-677, MK-0677, L-163,191Ibutamoren mesylate (MK-0667, L163191)
물성
구조 계산 물성
- XLogP
- 1.3
- 극성 표면적
- 130 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 37
- 형식 전하
- 0
- 복잡도
- 920
실험 및 물리화학적 성질
LogP2.37
물리화학적 성질
- 밀도
- 1.32 · 1.32
- 산도 계수 (pKa)
- 15.73 · 15.73±0.46(Predicted)
- 물리적 상태
- Solid
- 색상
- White to off-white
- InChIKey
- UMUPQWIGCOZEOY-JOCHJYFZSA-N
- SMILES
- C(N[C@H](COCC1=CC=CC=C1)C(N1CCC2(CC1)C1=C(N(S(C)(=O)=O)C2)C=CC=C1)=O)(=O)C(N)(C)C
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, 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.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 3 (100%)
안전 데이터
- 신호 어
- Danger
- 유해·위험 문구
- 암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H301
화학 및 산업
응용 분야
개요Ibutamoren (INN) (developmental code names MK-677, MK-0677, L-163,191)is a non-peptidic, potent, long acting, orally-active, and selective agonist of the ghrelin receptor and a growth hormone secretagogue, mimicking the growth hormone (GH)-stimulating action of the endogenous hormone ghrelin. It has been demonstrated to increase the release of, and produces sustained increases in plasma levels of several hormones including GH and insulin-like growth factor 1 (IGF-1), but without affecting cortisol levels. MK677 has shown to sustain activation of GH-IGF-1 Axis and increase in lean body mass but no change in total fat mass or visceral fat. It is currently under development as a potential treatment for reduced levels of these hormones, such as in children or elderly adults with growth hormone deficiency, and human studies have shown it to increase both muscle mass and bone mineral density, making it a promising therapy for the treatment of frailty in the elderly.
용도Growth hormone releasing factor.
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