기본 정보
- CAS
57645-12-2- 표준 SMILES
CCCCCc1cc(O)c2c(c1)OC(C)(C)CC2C1=CCN(Cc2ccc3ccccc3c2)CC1- InChIKey
RIYNPVPJWVVONN-UHFFFAOYSA-N- 분자식
- C32H39NO2
- 평균 분자량
- 469.7 g/mol
- 단동위원소 질량
- 469.29807949
이름 및 식별자
- 우선 이름
- 3,4-Dihydro-2,2-dimethyl-7-pentyl-4-(1,2,3,6-tetrahydro-1-(2-naphthalenylmethyl)-4-pyridinyl)-2H-1-benzopyran-5-ol
- IUPAC
- 2,2-dimethyl-4-[1-(naphthalen-2-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]-7-pentyl-3,4-dihydrochromen-5-ol
- 영어명
- 3,4-Dihydro-2,2-dimethyl-7-pentyl-4-[1,2,3,6-tetrahydro-1-(2-naphthalenylmethyl)pyridin-4-yl]-2H-1-benzopyran-5-ol
- 분자식
- C32H39NO2
- 분자량
- 469.66
이름 및 동의어
Brl-13776Brl 1377657645-12-22H-1-Benzopyran-5-ol, 3,4-dihydro-2,2-dimethyl-7-pentyl-4-(1,2,3,6-tetrahydro-1-(2-naphthalenylmethyl)-4-pyridinyl)-RefChem:9106013,4-Dihydro-2,2-dimethyl-7-pentyl-4-(1,2,3,6-tetrahydro-1-(2-naphthalenylmethyl)-4-pyridinyl)-2H-1-benzopyran-5-ol7-n-Pentyl-4-(1-(2-naphthylmethyl)-1,2,5,6-tetrahydro-4-pyridyl)-2,2-dimethylchroman-5-olDTXSID009732202,2-Dimethyl-4-{1-[(naphthalen-2-yl)methyl]-1,2,3,6-tetrahydropyridin-4-yl}-7-pentyl-3,4-dihydro-2H-1-benzopyran-5-olDB-3040953,4-Dihydro-2,2-dimethyl-7-pentyl-4-[1,2,3,6-tetrahydro-1-(2-naphthalenylmethyl)pyridin-4-yl ]-2h-1-benzopyran-5-ol3,4-Dihydro-2,2-dimethyl-7-pentyl-4-[1,2,3,6-tetrahydro-1-(2-naphthalenylmethyl)pyridin-4-yl]-2H-1-benzopyran-5-ol
이름 더 보기
2H-1-Benzopyran-5-ol, 3,4-dihydro-2,2-dimethyl-7-pentyl-4-[1,2,3,6-tetrahydro-1-(2-naphthalenylmethyl)-4-pyridinyl]-
물성
구조 계산 물성
- XLogP
- 7.8
- 극성 표면적
- 32.7 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 35
- 형식 전하
- 0
- 복잡도
- 716
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