Butyl-ethyl-[6-methoxy-2,5,5-trimethyl-7-(2,4,6-trimethylphenyl)-6,7-dihydro-5H-pyrrolo [2,3-d]pyrimidin-4-yl]-amine
기본 정보
- 표준 SMILES
CCCCN(CC)c1nc(C)nc2c1C(C)(C)C(OC)N2c1c(C)cc(C)cc1C- InChIKey
PZFCTZXDFUADSA-UHFFFAOYSA-N- 분자식
- C25H38N4O
- 평균 분자량
- 410.6 g/mol
이름 및 식별자
- 우선 이름
- Butyl-ethyl-[6-methoxy-2,5,5-trimethyl-7-(2,4,6-trimethylphenyl)-6,7-dihydro-5H-pyrrolo [2,3-d]pyrimidin-4-yl]-amine
- IUPAC
- N-butyl-N-ethyl-6-methoxy-2,5,5-trimethyl-7-(2,4,6-trimethylphenyl)-6H-pyrrolo[2,3-d]pyrimidin-4-amine
이름 및 동의어
SCHEMBL5844255PZFCTZXDFUADSA-UHFFFAOYSA-NButyl-ethyl-[6-methoxy-2,5,5-trimethyl-7-(2,4,6-trimethylphenyl)-6,7-dihydro-5H-pyrrolo [2,3-d]pyrimidin-4-yl]-amineButyl-ethyl-[6-methoxy-2,5,5-trimethyl-7-(2,4,6-trimethylphenyl)-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl]-amineButyl-ethyl-[6-methoxy-2,5,5-trimethyl-7-(2,4,6-trimethylphenyl)-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4yl]-amine
데이터베이스 식별자
- PubChem CID
- 21912372
물성
구조 계산 물성
- XLogP
- 6.7
- 극성 표면적
- 41.5 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 30
- 형식 전하
- 0
- 복잡도
- 543
관련 반응
4건
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