2-NITRO-N-[[TRANS-4-[[[(1,2,3,4-TETRAHYDRO-2-NAPHTHALENYL)메틸]아미노]메틸]시클로헥실]메틸]벤젠설폰아미드염산염
Ntncb hydrochloride
기본 정보
- CAS
486453-65-0- 표준 SMILES
Cl.O=[N+]([O-])c1ccccc1S(=O)(=O)NCC1CCC(CNCC2CCc3ccccc3C2)CC1- InChIKey
BKCQHNDMUNWNQC-UHFFFAOYSA-N- 분자식
- C25H34ClN3O4S
- 평균 분자량
- 508.1 g/mol
- 단동위원소 질량
- 507.1958554
이름 및 식별자
- 우선 이름
- Ntncb hydrochloride
- IUPAC
- 2-nitro-N-[[4-[(1,2,3,4-tetrahydronaphthalen-2-ylmethylamino)methyl]cyclohexyl]methyl]benzenesulfonamide;hydrochloride
- 현지명
- 2-NITRO-N-[[TRANS-4-[[[(1,2,3,4-TETRAHYDRO-2-NAPHTHALENYL)메틸]아미노]메틸]시클로헥실]메틸]벤젠설폰아미드염산염
- 영어명
- 2-Nitro-N-[[trans-4-[[[(1,2,3,4-tetrahydro-2-naphthalenyl)methyl]amino]methyl]cyclohexyl]methyl]benzenesulfonamide hydrochloride
- 분자식
- C25H33N3O4S
- 분자량
- 471.61
이름 및 동의어
NTNCB HYDROCHLORIDE191931-56-3486453-65-0NTNCB HClNTNCB (hydrochloride)2-Nitro-N-[[trans-4-[[[(1,2,3,4-tetrahydro-2-naphthalenyl)methyl]amino]methyl]cyclohexyl]methyl]benzenesulfonamide hydrochloride2-Nitro-N-[[trans-4-[[[(1,2,3,4-tetrahydro-2-naphthalenyl)methyl]amino]methyl]cyclohexyl]methyl]benzenesulfonamidehydrochlorideNTNCB HCl; NTNCB hydrochloride2-Nitro-N-((trans-4-((((1,2,3,4-tetrahydronaphthalen-2-yl)methyl)amino)methyl)cyclohexyl)methyl)benzenesulfonamide hydrochloride2-nitro-N-[[4-[(1,2,3,4-tetrahydronaphthalen-2-ylmethylamino)methyl]cyclohexyl]methyl]benzenesulfonamide;hydrochloride2-Nitro-N-(((1r,4r)-4-((((1,2,3,4-tetrahydronaphthalen-2-yl)methyl)amino)methyl)cyClohexyl)methyl)benzenesulfonamide hydroChlorideinhibit,NPY receptor,Neuropeptide Y Receptor,NTNCB hydrochloride,NTNCB,Inhibitor
이름 더 보기
2-NITRO-N-[[TRANS-4-[[[(1,2,3,4-TETRAHYDRO-2-NAPHTHALENYL)메틸]아미노]메틸]시클로헥실]메틸]벤젠설폰아미드염산염Benzenesulfonamide, 2-nitro-N-[[trans-4-[[[(1,2,3,4-tetrahydro-2-naphthalenyl)methyl]amino]methyl]cyclohexyl]methyl]-
Rel-2-nitro-N-(((1r,4r)-4-((((1,2,3,4-tetrahydronaphthalen-2-yl)methyl)amino)methyl)cyClohexyl)methyl)benzenesulfonamideorb1305729CHEMBL1435188SCHEMBL30887942DTXSID70587873AKOS024456960AKOS025295365AKOS040745280
데이터베이스 식별자
- CAS
486453-65-0- PubChem CID
- 16759158
- DTXSID
DTXSID70587873- ChEMBL
CHEMBL1435188
물성
구조 계산 물성
- 극성 표면적
- 112 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 34
- 형식 전하
- 0
- 복잡도
- 727
물리화학적 성질
- 끓는 점
- 638.407 · 638.407±61.00 °C(Press: 760.00 Torr)(predicted)
- 밀도
- 1.2 · 1.200±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- 저장 조건
- Store at RT
- 산도 계수 (pKa)
- 10.33 · 10.330±0.10(predicted)
관련 반응
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