기본 정보
- 표준 SMILES
COc1ccnc(CSc2nc3cc4c(cc3[nH]2)C(C)(C)C(=O)C4(C)C)c1C- InChIKey
RUTMNCYLHDVUCJ-UHFFFAOYSA-N- 분자식
- C22H25N3O2S
- 평균 분자량
- 395.5 g/mol
이름 및 식별자
- 우선 이름
- 2-[(4-methoxy-3-methylpyridin-2-yl)methylsulfanyl]-5,5,7,7-tetramethyl-3H-cyclopenta[f]benzimidazol-6-one
- IUPAC
- 2-[(4-methoxy-3-methyl-2-pyridinyl)methylsulfanyl]-5,5,7,7-tetramethyl-3H-cyclopenta[f]benzimidazol-6-one
이름 및 동의어
101387-97-7Ro18-53622-[(4-methoxy-3-methylpyridin-2-yl)methylsulfanyl]-5,5,7,7-tetramethyl-3H-cyclopenta[f]benzimidazol-6-one5,7-Dihydro-2-[(4-methoxy-3-methyl-2-pyridinyl)methylthio]-5,5,7,7-tetramethylindeno[5,6-d]imidazol-6(1H)-oneRUTMNCYLHDVUCJ-UHFFFAOYSA-Norb1706082SCHEMBL9784677HY-U00193AKOS040744361CS-7291DA-77509T19549
이름 더 보기
2-(((4-Methoxy-3-methylpyridin-2-yl)methyl)thio)-5,5,7,7-tetramethyl-5,7-dihydroindeno[5,6-d]imidazol-6(1H)-one5,7-dihydro-2-[[(4-methoxy-3 -methyl-2-pyridyl)methyl]thio]-5,5,7,7-tetramethylindeno[5,6-d]imidazol-6(1H)-one5,7-dihydro-2-[[(4-methoxy-3-methyl-2 -pyridyl)methyl]thio]-5,5,7,7-tetramethylindeno[5,6-d]imidazol-6(lH)-one5,7-dihydro-2-[[(4-methoxy-3-methyl-2-pyridyl)methyl]thio]-5,5,7,7-tetramethylindeno[5,6-d ]imidazol-6(lH)-one5,7-dihydro-2-[[(4-methoxy-3-methyl-2-pyridyl)methyl]thio]-5,5,7,7-tetramethylindeno[5,6-d]imidazol-6(1H)-one5,7-dihydro-2-[[(4-methoxy-3-methyl-2-pyridyl)methyl]thio]5,5,7,7-tetramethylindeno[5,6-d]imidazol-6(1H)-one5,7-dihydro-2[[(4-methoxy-3-methyl-2-pyridyl) methyl]thio]-5,5,7,7-tetramethylindeno[5,6-d]imidazol-6(lH)-one5,7-dihydro-2[[(4-methoxy-3-methyl-2-pyridyl)methyl]thio]-5,5,7,7-tetramethylindeno[5,6-d]imidazol-6(1H)-one
데이터베이스 식별자
- PubChem CID
- 9865473
- Nikkaji
- J326.133F
물성
구조 계산 물성
- XLogP
- 4.4
- 극성 표면적
- 93.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 28
- 형식 전하
- 0
- 복잡도
- 611
관련 반응
10건
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